N-(4-butylphenyl)-4-(4-methylpentanoyl)-1,4-diazepane-1-carboxamide

Systemtic Name: N-(4-butylphenyl)-4-(4-methylpentanoyl)-1,4-diazepane-1-carboxamide Openeye Name: N-(4-butylphenyl)-4-(4-methylpentanoyl)-1,4-diazepane-1-carboxamide CAS Name: N-(4-butylphenyl)-4-(4-methyl-1-oxopentyl)-1,4-diazepane-1-carboxamide IUPAC Name: N-(4-butylphenyl)-4-(4-methylpentanoyl)-1,4-diazepane-1-carboxamide Traditional Name: N-(4-butylphenyl)-4-(4-methylpentanoyl)-1,4-diazepane-1-carboxamide Formula: C22H35N3O2 MolecularWeight: 373.5322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)CCC(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)N2CCCN(CC2)C(=O)CCC(C)C

InChI

InChI=1S/C22H35N3O2/c1-4-5-7-19-9-11-20(12-10-19)23-22(27)25-15-6-14-24(16-17-25)21(26)13-8-18(2)3/h9-12,18H,4-8,13-17H2,1-3H3,(H,23,27)