[2-[2-(azepan-1-yl)ethyl]piperidin-1-yl]-(3-chloranyl-4-methoxy-phenyl)methanone

Systemtic Name: [2-[2-(azepan-1-yl)ethyl]piperidin-1-yl]-(3-chloranyl-4-methoxy-phenyl)methanone Openeye Name: [2-[2-(azepan-1-yl)ethyl]-1-piperidyl]-(3-chloro-4-methoxy-phenyl)methanone CAS Name: [2-[2-(1-azepanyl)ethyl]-1-piperidinyl]-(3-chloro-4-methoxyphenyl)methanone IUPAC Name: [2-[2-(azepan-1-yl)ethyl]piperidin-1-yl]-(3-chloro-4-methoxyphenyl)methanone Traditional Name: [2-[2-(azepan-1-yl)ethyl]piperidino]-(3-chloro-4-methoxy-phenyl)methanone Formula: C21H31ClN2O2 MolecularWeight: 378.93604

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCCCC2CCN3CCCCCC3)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCCCC2CCN3CCCCCC3)Cl

InChI

InChI=1S/C21H31ClN2O2/c1-26-20-10-9-17(16-19(20)22)21(25)24-14-7-4-8-18(24)11-15-23-12-5-2-3-6-13-23/h9-10,16,18H,2-8,11-15H2,1H3