[1-[4-[4-(azepan-1-yl)-4-oxidanylidene-3-phenyl-butyl]piperazin-1-yl]indol-2-yl] methyl carbonate

Systemtic Name: [1-[4-[4-(azepan-1-yl)-4-oxidanylidene-3-phenyl-butyl]piperazin-1-yl]indol-2-yl] methyl carbonate Openeye Name: [1-[4-[4-(azepan-1-yl)-4-oxo-3-phenyl-butyl]piperazin-1-yl]indol-2-yl] methyl carbonate CAS Name: carbonic acid [1-[4-[4-(1-azepanyl)-4-oxo-3-phenylbutyl]-1-piperazinyl]-2-indolyl] methyl ester IUPAC Name: [1-[4-[4-(azepan-1-yl)-4-oxo-3-phenylbutyl]piperazin-1-yl]indol-2-yl] methyl carbonate Traditional Name: carbonic acid [1-[4-[4-(azepan-1-yl)-4-keto-3-phenyl-butyl]piperazino]indol-2-yl] methyl ester Formula: C30H38N4O4 MolecularWeight: 518.64712

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)OC1=CC2=CC=CC=C2N1N3CCN(CC3)CCC(C4=CC=CC=C4)C(=O)N5CCCCCC5

Isomeric SMILES

COC(=O)OC1=CC2=CC=CC=C2N1N3CCN(CC3)CCC(C4=CC=CC=C4)C(=O)N5CCCCCC5

InChI

InChI=1S/C30H38N4O4/c1-37-30(36)38-28-23-25-13-7-8-14-27(25)34(28)33-21-19-31(20-22-33)18-15-26(24-11-5-4-6-12-24)29(35)32-16-9-2-3-10-17-32/h4-8,11-14,23,26H,2-3,9-10,15-22H2,1H3