1-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-4-phenyl-piperazine-2,3-dione

Systemtic Name: 1-[[4-(azepan-1-ylcarbonyl)phenyl]methyl]-4-phenyl-piperazine-2,3-dione Openeye Name: 1-[[4-(azepane-1-carbonyl)phenyl]methyl]-4-phenyl-piperazine-2,3-dione CAS Name: 1-[[4-[1-azepanyl(oxo)methyl]phenyl]methyl]-4-phenylpiperazine-2,3-dione IUPAC Name: 1-[[4-(azepane-1-carbonyl)phenyl]methyl]-4-phenylpiperazine-2,3-dione Traditional Name: 1-[4-(azepane-1-carbonyl)benzyl]-4-phenyl-piperazine-2,3-quinone Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCN(C(=O)C3=O)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CC=C(C=C2)CN3CCN(C(=O)C3=O)C4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3/c28-22(25-14-6-1-2-7-15-25)20-12-10-19(11-13-20)18-26-16-17-27(24(30)23(26)29)21-8-4-3-5-9-21/h3-5,8-13H,1-2,6-7,14-18H2