4-(azepan-1-ylmethyl)-N-[1-(3,4-dimethylphenyl)propyl]benzamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-[1-(3,4-dimethylphenyl)propyl]benzamide Openeye Name: 4-(azepan-1-ylmethyl)-N-[1-(3,4-dimethylphenyl)propyl]benzamide CAS Name: 4-(1-azepanylmethyl)-N-[1-(3,4-dimethylphenyl)propyl]benzamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-[1-(3,4-dimethylphenyl)propyl]benzamide Traditional Name: 4-(azepan-1-ylmethyl)-N-[1-(3,4-dimethylphenyl)propyl]benzamide Formula: C25H34N2O MolecularWeight: 378.55026

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)C)C)NC(=O)C2=CC=C(C=C2)CN3CCCCCC3

Isomeric SMILES

CCC(C1=CC(=C(C=C1)C)C)NC(=O)C2=CC=C(C=C2)CN3CCCCCC3

InChI

InChI=1S/C25H34N2O/c1-4-24(23-12-9-19(2)20(3)17-23)26-25(28)22-13-10-21(11-14-22)18-27-15-7-5-6-8-16-27/h9-14,17,24H,4-8,15-16,18H2,1-3H3,(H,26,28)