N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide

Systemtic Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide Openeye Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylindol-5-yl)sulfonyl-piperidine-3-carboxamide CAS Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(1-methyl-5-indolyl)sulfonyl]-3-piperidinecarboxamide IUPAC Name: N-[2-(3,4-dimethoxyphenyl)ethyl]-1-(1-methylindol-5-yl)sulfonylpiperidine-3-carboxamide Traditional Name: N-homoveratryl-1-(1-methylindol-5-yl)sulfonyl-nipecotamide Formula: C25H31N3O5S MolecularWeight: 485.59574

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CN1C=CC2=C1C=CC(=C2)S(=O)(=O)N3CCCC(C3)C(=O)NCCC4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C25H31N3O5S/c1-27-14-11-19-16-21(7-8-22(19)27)34(30,31)28-13-4-5-20(17-28)25(29)26-12-10-18-6-9-23(32-2)24(15-18)33-3/h6-9,11,14-16,20H,4-5,10,12-13,17H2,1-3H3,(H,26,29)