N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(phenylsulfonyl)pyrrolidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-1-(phenylsulfonyl)pyrrolidine-3-carboxamide Openeye Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide CAS Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: 1-(benzenesulfonyl)-N-(1,3-benzodioxol-5-ylmethyl)-4-(3-methoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: 1-besyl-4-(3-methoxyphenyl)-N-piperonyl-pyrrolidine-3-carboxamide Formula: C26H26N2O6S MolecularWeight: 494.55944

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2CN(CC2C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC(=C1)C2CN(CC2C(=O)NCC3=CC4=C(C=C3)OCO4)S(=O)(=O)C5=CC=CC=C5

InChI

InChI=1S/C26H26N2O6S/c1-32-20-7-5-6-19(13-20)22-15-28(35(30,31)21-8-3-2-4-9-21)16-23(22)26(29)27-14-18-10-11-24-25(12-18)34-17-33-24/h2-13,22-23H,14-17H2,1H3,(H,27,29)