[1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]-(2-methoxyphenyl)methanone

Systemtic Name: [1-[(6-chloranyl-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]-(2-methoxyphenyl)methanone Openeye Name: [1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-piperidyl]-(2-methoxyphenyl)methanone CAS Name: [1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-piperidinyl]-(2-methoxyphenyl)methanone IUPAC Name: [1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]piperidin-3-yl]-(2-methoxyphenyl)methanone Traditional Name: [1-[(6-chloro-1,3-benzodioxol-5-yl)methyl]-3-piperidyl]-(2-methoxyphenyl)methanone Formula: C21H22ClNO4 MolecularWeight: 387.85668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)C2CCCN(C2)CC3=CC4=C(C=C3Cl)OCO4

Isomeric SMILES

COC1=CC=CC=C1C(=O)C2CCCN(C2)CC3=CC4=C(C=C3Cl)OCO4

InChI

InChI=1S/C21H22ClNO4/c1-25-18-7-3-2-6-16(18)21(24)14-5-4-8-23(11-14)12-15-9-19-20(10-17(15)22)27-13-26-19/h2-3,6-7,9-10,14H,4-5,8,11-13H2,1H3