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N-ISOPROPYL-6-OXO-BENZO-[4,5]-CANTHINE-2-CARBXAMIDE
SpectraBase Compound ID 8OGMfmq8lkJ
InChI InChI=1S/C22H17N3O2/c1-12(2)23-21(26)17-11-16-13-7-5-6-10-18(13)25-20(16)19(24-17)14-8-3-4-9-15(14)22(25)27/h3-12H,1-2H3,(H,23,26)
InChIKey SZZPXBUSOLIYMV-UHFFFAOYSA-N
Mol Weight 355.4 g/mol
Molecular Formula C22H17N3O2
Exact Mass 355.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2in4uv0BNo
Name N-Isopropyl-6-oxobenzo[4,5] canthine-2-carboxamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H17N3O2
InChI InChI=1S/C22H17N3O2/c1-12(2)23-21(26)17-11-16-13-7-5-6-10-18(13)25-20(16)19(24-17)14-8-3-4-9-15(14)22(25)27/h3-12H,1-2H3,(H,23,26)
InChIKey SZZPXBUSOLIYMV-UHFFFAOYSA-N
Molecular Weight 355.397 g/mol
SMILES N(C(c1nc-2c3[n](C(c4ccccc24)=O)c2c(cccc2)c3c1)=O)C(C)C
SPLASH splash10-0ab9-4091000000-6ebd5ec98d09966187ff
Source of Spectrum E1-60-1378-13a
Synonyms N-isopropyl-8-oxo-8H-benzo[c]indolo[3,2,1-ij][1,5]naphthyridine-2-carboxamide
Wiley ID 1738935