1-[1-[3-(azepan-3-yl)propyl]indol-3-yl]-3-phenylazanyl-pyrrole-2,5-dione

Systemtic Name: 1-[1-[3-(azepan-3-yl)propyl]indol-3-yl]-3-phenylazanyl-pyrrole-2,5-dione Openeye Name: 3-anilino-1-[1-[3-(azepan-3-yl)propyl]indol-3-yl]pyrrole-2,5-dione CAS Name: 3-anilino-1-[1-[3-(3-azepanyl)propyl]-3-indolyl]pyrrole-2,5-dione IUPAC Name: 3-anilino-1-[1-[3-(azepan-3-yl)propyl]indol-3-yl]pyrrole-2,5-dione Traditional Name: 3-anilino-1-[1-[3-(azepan-3-yl)propyl]indol-3-yl]-3-pyrroline-2,5-quinone Formula: C27H30N4O2 MolecularWeight: 442.5527

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNCC(C1)CCCN2C=C(C3=CC=CC=C32)N4C(=O)C=C(C4=O)NC5=CC=CC=C5

Isomeric SMILES

C1CCNCC(C1)CCCN2C=C(C3=CC=CC=C32)N4C(=O)C=C(C4=O)NC5=CC=CC=C5

InChI

InChI=1S/C27H30N4O2/c32-26-17-23(29-21-11-2-1-3-12-21)27(33)31(26)25-19-30(24-14-5-4-13-22(24)25)16-8-10-20-9-6-7-15-28-18-20/h1-5,11-14,17,19-20,28-29H,6-10,15-16,18H2