4-(4-methoxyphenyl)carbonyl-N-phenethyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(4-methoxyphenyl)carbonyl-N-phenethyl-1,4-diazepane-1-carboxamide Openeye Name: 4-(4-methoxybenzoyl)-N-phenethyl-1,4-diazepane-1-carboxamide CAS Name: 4-[(4-methoxyphenyl)-oxomethyl]-N-phenethyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-(4-methoxybenzoyl)-N-phenethyl-1,4-diazepane-1-carboxamide Traditional Name: 4-p-anisoyl-N-phenethyl-1,4-diazepane-1-carboxamide Formula: C22H27N3O3 MolecularWeight: 381.46808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)NCCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)N2CCCN(CC2)C(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O3/c1-28-20-10-8-19(9-11-20)21(26)24-14-5-15-25(17-16-24)22(27)23-13-12-18-6-3-2-4-7-18/h2-4,6-11H,5,12-17H2,1H3,(H,23,27)