2-methoxy-5-(1-phenylbutan-2-ylsulfonyl)-N-pyrrolidin-1-yl-benzamide hydrochloride

Systemtic Name: 2-methoxy-5-(1-phenylbutan-2-ylsulfonyl)-N-pyrrolidin-1-yl-benzamide hydrochloride Openeye Name: 5-(1-benzylpropylsulfonyl)-2-methoxy-N-pyrrolidin-1-yl-benzamide hydrochloride CAS Name: 2-methoxy-5-(1-phenylbutan-2-ylsulfonyl)-N-(1-pyrrolidinyl)benzamide hydrochloride IUPAC Name: 2-methoxy-5-(1-phenylbutan-2-ylsulfonyl)-N-pyrrolidin-1-ylbenzamide hydrochloride Traditional Name: 5-(1-benzylpropylsulfonyl)-2-methoxy-N-pyrrolidino-benzamide hydrochloride Formula: C22H29ClN2O4S MolecularWeight: 452.99466

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NN3CCCC3.Cl

Isomeric SMILES

CCC(CC1=CC=CC=C1)S(=O)(=O)C2=CC(=C(C=C2)OC)C(=O)NN3CCCC3.Cl

InChI

InChI=1S/C22H28N2O4S.ClH/c1-3-18(15-17-9-5-4-6-10-17)29(26,27)19-11-12-21(28-2)20(16-19)22(25)23-24-13-7-8-14-24;/h4-6,9-12,16,18H,3,7-8,13-15H2,1-2H3,(H,23,25);1H