4-(3-azanylpropyl)-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide

Systemtic Name: 4-(3-azanylpropyl)-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide Openeye Name: 4-(3-aminopropyl)-N-(p-tolyl)-1,4-diazepane-1-carboxamide CAS Name: 4-(3-aminopropyl)-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide IUPAC Name: 4-(3-aminopropyl)-N-(4-methylphenyl)-1,4-diazepane-1-carboxamide Traditional Name: 4-(3-aminopropyl)-N-(p-tolyl)-1,4-diazepane-1-carboxamide Formula: C16H26N4O MolecularWeight: 290.40384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)CCCN

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)CCCN

InChI

InChI=1S/C16H26N4O/c1-14-4-6-15(7-5-14)18-16(21)20-11-3-10-19(12-13-20)9-2-8-17/h4-7H,2-3,8-13,17H2,1H3,(H,18,21)