1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one Openeye Name: 1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-[4-(1-piperidylsulfonyl)phenyl]propan-1-one CAS Name: 1-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-3-[4-(1-piperidinylsulfonyl)phenyl]-1-propanone IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-3-(4-piperidin-1-ylsulfonylphenyl)propan-1-one Traditional Name: 1-[2-(3,4-dimethoxyphenyl)pyrrolidino]-3-(4-piperidinosulfonylphenyl)propan-1-one Formula: C26H34N2O5S MolecularWeight: 486.62356

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)CCC3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)OC

InChI

InChI=1S/C26H34N2O5S/c1-32-24-14-11-21(19-25(24)33-2)23-7-6-18-28(23)26(29)15-10-20-8-12-22(13-9-20)34(30,31)27-16-4-3-5-17-27/h8-9,11-14,19,23H,3-7,10,15-18H2,1-2H3