N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-2-phenoxy-ethanamide

Systemtic Name: N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-2-phenoxy-ethanamide Openeye Name: N-[2-oxo-2-[4-(p-tolylmethyl)-1,4-diazepan-1-yl]ethyl]-2-phenoxy-acetamide CAS Name: N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-2-phenoxyacetamide IUPAC Name: N-[2-[4-[(4-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-2-phenoxyacetamide Traditional Name: N-[2-keto-2-[4-(4-methylbenzyl)-1,4-diazepan-1-yl]ethyl]-2-phenoxy-acetamide Formula: C23H29N3O3 MolecularWeight: 395.49466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CNC(=O)COC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCCN(CC2)C(=O)CNC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C23H29N3O3/c1-19-8-10-20(11-9-19)17-25-12-5-13-26(15-14-25)23(28)16-24-22(27)18-29-21-6-3-2-4-7-21/h2-4,6-11H,5,12-18H2,1H3,(H,24,27)