N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-3,5-dimethyl-benzamide

Systemtic Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxidanylidene-ethyl]-3,5-dimethyl-benzamide Openeye Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxo-ethyl]-3,5-dimethyl-benzamide CAS Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-3,5-dimethylbenzamide IUPAC Name: N-[2-[4-[(4-methoxyphenyl)methyl]-1,4-diazepan-1-yl]-2-oxoethyl]-3,5-dimethylbenzamide Traditional Name: N-[2-keto-2-(4-p-anisyl-1,4-diazepan-1-yl)ethyl]-3,5-dimethyl-benzamide Formula: C24H31N3O3 MolecularWeight: 409.52124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C24H31N3O3/c1-18-13-19(2)15-21(14-18)24(29)25-16-23(28)27-10-4-9-26(11-12-27)17-20-5-7-22(30-3)8-6-20/h5-8,13-15H,4,9-12,16-17H2,1-3H3,(H,25,29)