[3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]piperidin-1-yl]-thiophen-3-yl-methanone

Systemtic Name: [3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]piperidin-1-yl]-thiophen-3-yl-methanone Openeye Name: [3-[2-(3,4-dimethoxyphenyl)ethyl-methyl-amino]-1-piperidyl]-(3-thienyl)methanone CAS Name: [3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]-1-piperidinyl]-(3-thiophenyl)methanone IUPAC Name: [3-[2-(3,4-dimethoxyphenyl)ethyl-methylamino]piperidin-1-yl]-thiophen-3-ylmethanone Traditional Name: [3-[homoveratryl(methyl)amino]piperidino]-(3-thienyl)methanone Formula: C21H28N2O3S MolecularWeight: 388.52362

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)C(=O)C3=CSC=C3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C2CCCN(C2)C(=O)C3=CSC=C3

InChI

InChI=1S/C21H28N2O3S/c1-22(11-8-16-6-7-19(25-2)20(13-16)26-3)18-5-4-10-23(14-18)21(24)17-9-12-27-15-17/h6-7,9,12-13,15,18H,4-5,8,10-11,14H2,1-3H3