(4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-phenethylpiperidin-1-yl)methanone

Systemtic Name: (4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-phenethylpiperidin-1-yl)methanone Openeye Name: (4-methoxy-3-pyrrolidin-1-ylsulfonyl-phenyl)-(4-phenethyl-1-piperidyl)methanone CAS Name: [4-methoxy-3-(1-pyrrolidinylsulfonyl)phenyl]-(4-phenethyl-1-piperidinyl)methanone IUPAC Name: (4-methoxy-3-pyrrolidin-1-ylsulfonylphenyl)-(4-phenethylpiperidin-1-yl)methanone Traditional Name: (4-methoxy-3-pyrrolidinosulfonyl-phenyl)-(4-phenethylpiperidino)methanone Formula: C25H32N2O4S MolecularWeight: 456.59758

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)CCC3=CC=CC=C3)S(=O)(=O)N4CCCC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCC(CC2)CCC3=CC=CC=C3)S(=O)(=O)N4CCCC4

InChI

InChI=1S/C25H32N2O4S/c1-31-23-12-11-22(19-24(23)32(29,30)27-15-5-6-16-27)25(28)26-17-13-21(14-18-26)10-9-20-7-3-2-4-8-20/h2-4,7-8,11-12,19,21H,5-6,9-10,13-18H2,1H3