2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-6-iodo-3-(4-nitrophenyl)-4(3H)-quinazolinone

SpectraBase Compound ID	7CTcJrrGYLH
InChI	InChI=1S/C31H21IN4O3/c32-23-11-16-28-27(18-23)31(37)35(24-12-14-25(15-13-24)36(38)39)30(33-28)17-10-22-20-34(19-21-6-2-1-3-7-21)29-9-5-4-8-26(22)29/h1-18,20H,19H2/b17-10+
InChIKey	NJDRTAXKNHAKNM-LICLKQGHSA-N Google Search
Mol Weight	624.44 g/mol
Molecular Formula	C31H21IN4O3
Exact Mass	624.065836 g/mol

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SpectraBase Spectrum ID	A57h7bLZsMq
Name	2-[(E)-2-(1-benzyl-1H-indol-3-yl)ethenyl]-6-iodo-3-(4-nitrophenyl)-4(3H)-quinazolinone
Author	A.V.Yarkov, IPAC, Russia
Copyright	Copyright © 2016-2024 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright © 2016-2021 John Wiley & Sons, Inc. All Rights Reserved.
InChI	InChI=1S/C31H21IN4O3/c32-23-11-16-28-27(18-23)31(37)35(24-12-14-25(15-13-24)36(38)39)30(33-28)17-10-22-20-34(19-21-6-2-1-3-7-21)29-9-5-4-8-26(22)29/h1-18,20H,19H2/b17-10+
InChIKey	NJDRTAXKNHAKNM-LICLKQGHSA-N
NMR Offset	17.9631
NMR Spectrometer Frequency	500.138
Observed nucleus	1H
Origin	1H_SBI_36227_15612
Owner	Copyright (C) 2016 Chemical Block, Russia, Leninsky Prospect 47 - Database Compilation Copyright (C) 2016 John Wiley & Sons, Inc.
Sample State	soluted
Solvent	DMSO-d6
Source File Reference	VendorID: C74343; Labnumber: AENIC7-952; SBI_ID: SBI-015615
Synonyms	2-[2-(1-benzyl-1H-indol-3-yl)ethenyl]-6-iodo-3-(4-nitrophenyl)-4(3H)-quinazolinone
Temperature	313 °C