4-methoxy-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-methoxy-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-methoxy-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-methoxy-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-methoxy-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-methoxy-N-methyl-N-[1-(3-nitrophenyl)ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H25N3O6S MolecularWeight: 447.5047

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC(C1=CC(=CC=C1)[N+](=O)[O-])N(C)C(=O)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C21H25N3O6S/c1-15(16-7-6-8-18(13-16)24(26)27)22(2)21(25)17-9-10-19(30-3)20(14-17)31(28,29)23-11-4-5-12-23/h6-10,13-15H,4-5,11-12H2,1-3H3