N-[(3,4-dimethoxyphenyl)methyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methoxy-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methoxy-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(3,4-dimethoxyphenyl)methyl]-2-methoxy-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 2-methoxy-5-pyrrolidinosulfonyl-N-veratryl-benzamide Formula: C21H26N2O6S MolecularWeight: 434.50594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCCC2)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H26N2O6S/c1-27-18-9-7-16(30(25,26)23-10-4-5-11-23)13-17(18)21(24)22-14-15-6-8-19(28-2)20(12-15)29-3/h6-9,12-13H,4-5,10-11,14H2,1-3H3,(H,22,24)