propan-2-yl (2R,3S)-3-acetamido-2-[(2-nitrophenyl)sulfonylamino]-3-phenyl-propanoate

Systemtic Name: propan-2-yl (2R,3S)-3-acetamido-2-[(2-nitrophenyl)sulfonylamino]-3-phenyl-propanoate Openeye Name: isopropyl (2R,3S)-3-acetamido-2-[(2-nitrophenyl)sulfonylamino]-3-phenyl-propanoate CAS Name: (2R,3S)-3-acetamido-2-[(2-nitrophenyl)sulfonylamino]-3-phenylpropanoic acid propan-2-yl ester IUPAC Name: propan-2-yl (2R,3S)-3-acetamido-2-[(2-nitrophenyl)sulfonylamino]-3-phenylpropanoate Traditional Name: (2R,3S)-3-acetamido-2-[(2-nitrophenyl)sulfonylamino]-3-phenyl-propionic acid isopropyl ester Formula: C20H23N3O7S MolecularWeight: 449.47752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(C)OC(=O)[C@@H]([C@H](C1=CC=CC=C1)NC(=O)C)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]

InChI

InChI=1S/C20H23N3O7S/c1-13(2)30-20(25)19(18(21-14(3)24)15-9-5-4-6-10-15)22-31(28,29)17-12-8-7-11-16(17)23(26)27/h4-13,18-19,22H,1-3H3,(H,21,24)/t18-,19+/m0/s1