2-{[(2E)-2-cyano-3-(1H-indol-3-yl)-2-propenoyl]amino}benzoic acid

SpectraBase Compound ID	DGLOKHFoTza
InChI	InChI=1S/C19H13N3O3/c20-10-12(9-13-11-21-16-7-3-1-5-14(13)16)18(23)22-17-8-4-2-6-15(17)19(24)25/h1-9,11,21H,(H,22,23)(H,24,25)/b12-9+
InChIKey	DPTOHSXUKSBCQV-FMIVXFBMSA-N Google Search
Mol Weight	331.33 g/mol
Molecular Formula	C19H13N3O3
Exact Mass	331.095691 g/mol

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SpectraBase Spectrum ID	8jv2At1YTlc
Name	2-{[(2E)-2-cyano-3-(1H-indol-3-yl)-2-propenoyl]amino}benzoic acid
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/C19H13N3O3/c20-10-12(9-13-11-21-16-7-3-1-5-14(13)16)18(23)22-17-8-4-2-6-15(17)19(24)25/h1-9,11,21H,(H,22,23)(H,24,25)/b12-9+
InChIKey	DPTOHSXUKSBCQV-FMIVXFBMSA-N
NMR Offset	15.328
NMR Spectrometer Frequency	300.135
Observed nucleus	1H
Origin	1H_UBI_21270_7713
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: 9686878; UBI_ID: UBI-007716
Synonyms	2-{[2-cyano-3-(1H-indol-3-yl)-2-propenoyl]amino}benzoic acid
Temperature	318 °C