1-[4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-phenyl]ethanone

Systemtic Name: 1-[4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-phenyl]ethanone Openeye Name: 1-[4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-phenyl]ethanone CAS Name: 1-[4-[2-(1H-indol-3-yl)ethylamino]-3-nitrophenyl]ethanone IUPAC Name: 1-[4-[2-(1H-indol-3-yl)ethylamino]-3-nitrophenyl]ethanone Traditional Name: 1-[4-[2-(1H-indol-3-yl)ethylamino]-3-nitro-phenyl]ethanone Formula: C18H17N3O3 MolecularWeight: 323.34588

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NCCC2=CNC3=CC=CC=C32)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NCCC2=CNC3=CC=CC=C32)[N+](=O)[O-]

InChI

InChI=1S/C18H17N3O3/c1-12(22)13-6-7-17(18(10-13)21(23)24)19-9-8-14-11-20-16-5-3-2-4-15(14)16/h2-7,10-11,19-20H,8-9H2,1H3