4-(azepan-1-ylmethyl)-N-(2,3-dimethylphenyl)piperidine-1-carboxamide

Systemtic Name: 4-(azepan-1-ylmethyl)-N-(2,3-dimethylphenyl)piperidine-1-carboxamide Openeye Name: 4-(azepan-1-ylmethyl)-N-(2,3-dimethylphenyl)piperidine-1-carboxamide CAS Name: 4-(1-azepanylmethyl)-N-(2,3-dimethylphenyl)-1-piperidinecarboxamide IUPAC Name: 4-(azepan-1-ylmethyl)-N-(2,3-dimethylphenyl)piperidine-1-carboxamide Traditional Name: 4-(azepan-1-ylmethyl)-N-(2,3-dimethylphenyl)piperidine-1-carboxamide Formula: C21H33N3O MolecularWeight: 343.50622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)N2CCC(CC2)CN3CCCCCC3)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)N2CCC(CC2)CN3CCCCCC3)C

InChI

InChI=1S/C21H33N3O/c1-17-8-7-9-20(18(17)2)22-21(25)24-14-10-19(11-15-24)16-23-12-5-3-4-6-13-23/h7-9,19H,3-6,10-16H2,1-2H3,(H,22,25)