4-(3-methylphenyl)carbonyl-N-propyl-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(3-methylphenyl)carbonyl-N-propyl-1,4-diazepane-1-carboxamide Openeye Name: 4-(3-methylbenzoyl)-N-propyl-1,4-diazepane-1-carboxamide CAS Name: 4-[(3-methylphenyl)-oxomethyl]-N-propyl-1,4-diazepane-1-carboxamide IUPAC Name: 4-(3-methylbenzoyl)-N-propyl-1,4-diazepane-1-carboxamide Traditional Name: 4-m-toluoyl-N-propyl-1,4-diazepane-1-carboxamide Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCNC(=O)N1CCCN(CC1)C(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C17H25N3O2/c1-3-8-18-17(22)20-10-5-9-19(11-12-20)16(21)15-7-4-6-14(2)13-15/h4,6-7,13H,3,5,8-12H2,1-2H3,(H,18,22)