propan-2-yl 3-(2-nitrophenyl)-3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]propanoate

Systemtic Name: propan-2-yl 3-(2-nitrophenyl)-3-[(3-pyrrolidin-1-ylsulfonylphenyl)carbonylamino]propanoate Openeye Name: isopropyl 3-(2-nitrophenyl)-3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]propanoate CAS Name: 3-(2-nitrophenyl)-3-[[oxo-[3-(1-pyrrolidinylsulfonyl)phenyl]methyl]amino]propanoic acid propan-2-yl ester IUPAC Name: propan-2-yl 3-(2-nitrophenyl)-3-[(3-pyrrolidin-1-ylsulfonylbenzoyl)amino]propanoate Traditional Name: 3-(2-nitrophenyl)-3-[(3-pyrrolidinosulfonylbenzoyl)amino]propionic acid isopropyl ester Formula: C23H27N3O7S MolecularWeight: 489.54138

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H27N3O7S/c1-16(2)33-22(27)15-20(19-10-3-4-11-21(19)26(29)30)24-23(28)17-8-7-9-18(14-17)34(31,32)25-12-5-6-13-25/h3-4,7-11,14,16,20H,5-6,12-13,15H2,1-2H3,(H,24,28)