3-[1-[[3-(aminomethyl)phenyl]methyl]-5-bromanyl-indol-3-yl]-1H-quinoxalin-2-one

Systemtic Name: 3-[1-[[3-(aminomethyl)phenyl]methyl]-5-bromanyl-indol-3-yl]-1H-quinoxalin-2-one Openeye Name: 3-[1-[[3-(aminomethyl)phenyl]methyl]-5-bromo-indol-3-yl]-1H-quinoxalin-2-one CAS Name: 3-[1-[[3-(aminomethyl)phenyl]methyl]-5-bromo-3-indolyl]-1H-quinoxalin-2-one IUPAC Name: 3-[1-[[3-(aminomethyl)phenyl]methyl]-5-bromoindol-3-yl]-1H-quinoxalin-2-one Traditional Name: 3-[1-[3-(aminomethyl)benzyl]-5-bromo-indol-3-yl]-1H-quinoxalin-2-one Formula: C24H19BrN4O MolecularWeight: 459.33786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=O)C(=N2)C3=CN(C4=C3C=C(C=C4)Br)CC5=CC(=CC=C5)CN

Isomeric SMILES

C1=CC=C2C(=C1)NC(=O)C(=N2)C3=CN(C4=C3C=C(C=C4)Br)CC5=CC(=CC=C5)CN

InChI

InChI=1S/C24H19BrN4O/c25-17-8-9-22-18(11-17)19(14-29(22)13-16-5-3-4-15(10-16)12-26)23-24(30)28-21-7-2-1-6-20(21)27-23/h1-11,14H,12-13,26H2,(H,28,30)