N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]-4-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=C(C=C2)S(=O)(=O)N3CCCCC3)N4CCCC4

Isomeric SMILES

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

InChI

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