4-(azepan-1-ylcarbonyl)-N-[2-(3-methylphenoxy)ethyl]piperidine-1-carboxamide

Systemtic Name: 4-(azepan-1-ylcarbonyl)-N-[2-(3-methylphenoxy)ethyl]piperidine-1-carboxamide Openeye Name: 4-(azepane-1-carbonyl)-N-[2-(3-methylphenoxy)ethyl]piperidine-1-carboxamide CAS Name: 4-[1-azepanyl(oxo)methyl]-N-[2-(3-methylphenoxy)ethyl]-1-piperidinecarboxamide IUPAC Name: 4-(azepane-1-carbonyl)-N-[2-(3-methylphenoxy)ethyl]piperidine-1-carboxamide Traditional Name: 4-(azepane-1-carbonyl)-N-[2-(3-methylphenoxy)ethyl]piperidine-1-carboxamide Formula: C22H33N3O3 MolecularWeight: 387.51572

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCNC(=O)N2CCC(CC2)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=CC=C1)OCCNC(=O)N2CCC(CC2)C(=O)N3CCCCCC3

InChI

InChI=1S/C22H33N3O3/c1-18-7-6-8-20(17-18)28-16-11-23-22(27)25-14-9-19(10-15-25)21(26)24-12-4-2-3-5-13-24/h6-8,17,19H,2-5,9-16H2,1H3,(H,23,27)