2-[(4-nitrophenyl)sulfonyl-phenacyl-amino]-3-phenyl-propanoic acid

Systemtic Name: 2-[(4-nitrophenyl)sulfonyl-phenacyl-amino]-3-phenyl-propanoic acid Openeye Name: 2-[(4-nitrophenyl)sulfonyl-phenacyl-amino]-3-phenyl-propanoic acid CAS Name: 2-[(4-nitrophenyl)sulfonyl-phenacylamino]-3-phenylpropanoic acid IUPAC Name: 2-[(4-nitrophenyl)sulfonyl-phenacylamino]-3-phenylpropanoic acid Traditional Name: 2-[nosyl(phenacyl)amino]-3-phenyl-propionic acid Formula: C23H20N2O7S MolecularWeight: 468.4791

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N(CC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CC(C(=O)O)N(CC(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O7S/c26-22(18-9-5-2-6-10-18)16-24(21(23(27)28)15-17-7-3-1-4-8-17)33(31,32)20-13-11-19(12-14-20)25(29)30/h1-14,21H,15-16H2,(H,27,28)