4-[(4-ethoxyphenyl)methyl]-3-[2-oxidanylidene-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one

Systemtic Name: 4-[(4-ethoxyphenyl)methyl]-3-[2-oxidanylidene-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one Openeye Name: 4-[(4-ethoxyphenyl)methyl]-3-[2-oxo-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one CAS Name: 4-[(4-ethoxyphenyl)methyl]-3-[2-oxo-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]-2-piperazinone IUPAC Name: 4-[(4-ethoxyphenyl)methyl]-3-[2-oxo-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one Traditional Name: 4-(4-ethoxybenzyl)-3-[2-keto-2-(4-phenyl-1,4-diazepan-1-yl)ethyl]piperazin-2-one Formula: C26H34N4O3 MolecularWeight: 450.57316

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCNC(=O)C2CC(=O)N3CCCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCNC(=O)C2CC(=O)N3CCCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C26H34N4O3/c1-2-33-23-11-9-21(10-12-23)20-30-16-13-27-26(32)24(30)19-25(31)29-15-6-14-28(17-18-29)22-7-4-3-5-8-22/h3-5,7-12,24H,2,6,13-20H2,1H3,(H,27,32)