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

Systemtic Name: 4-ethoxy-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]benzamide Openeye Name: 4-ethoxy-N-[2-[4-(o-tolylmethyl)-1,4-diazepan-1-yl]-2-oxo-ethyl]benzamide CAS Name: 4-ethoxy-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]benzamide IUPAC Name: 4-ethoxy-N-[2-[4-[(2-methylphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]benzamide Traditional Name: 4-ethoxy-N-[2-keto-2-[4-(2-methylbenzyl)-1,4-diazepan-1-yl]ethyl]benzamide Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3C

InChI

InChI=1S/C24H31N3O3/c1-3-30-22-11-9-20(10-12-22)24(29)25-17-23(28)27-14-6-13-26(15-16-27)18-21-8-5-4-7-19(21)2/h4-5,7-12H,3,6,13-18H2,1-2H3,(H,25,29)