N-[(3-ethoxyphenyl)methyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(3-ethoxyphenyl)methyl]-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-(3-ethoxybenzyl)-2-methyl-5-pyrrolidinosulfonyl-benzamide Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)C

Isomeric SMILES

CCOC1=CC=CC(=C1)CNC(=O)C2=C(C=CC(=C2)S(=O)(=O)N3CCCC3)C

InChI

InChI=1S/C21H26N2O4S/c1-3-27-18-8-6-7-17(13-18)15-22-21(24)20-14-19(10-9-16(20)2)28(25,26)23-11-4-5-12-23/h6-10,13-14H,3-5,11-12,15H2,1-2H3,(H,22,24)