N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-3-piperidinosulfonyl-benzamide Formula: C25H33N3O4S MolecularWeight: 471.61222

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)N4CCCC4

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCCC3)N4CCCC4

InChI

InChI=1S/C25H33N3O4S/c1-32-22-11-7-9-20(17-22)24(27-13-5-6-14-27)19-26-25(29)21-10-8-12-23(18-21)33(30,31)28-15-3-2-4-16-28/h7-12,17-18,24H,2-6,13-16,19H2,1H3,(H,26,29)