3,4,5-trimethoxy-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide

Systemtic Name: 3,4,5-trimethoxy-N-[2-oxidanylidene-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide Openeye Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxo-ethyl]-3,4,5-trimethoxy-benzamide CAS Name: 3,4,5-trimethoxy-N-[2-oxo-2-[4-(phenylmethyl)-1,4-diazepan-1-yl]ethyl]benzamide IUPAC Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-oxoethyl]-3,4,5-trimethoxybenzamide Traditional Name: N-[2-(4-benzyl-1,4-diazepan-1-yl)-2-keto-ethyl]-3,4,5-trimethoxy-benzamide Formula: C24H31N3O5 MolecularWeight: 441.52004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NCC(=O)N2CCCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C24H31N3O5/c1-30-20-14-19(15-21(31-2)23(20)32-3)24(29)25-16-22(28)27-11-7-10-26(12-13-27)17-18-8-5-4-6-9-18/h4-6,8-9,14-15H,7,10-13,16-17H2,1-3H3,(H,25,29)