(2S)-2-[(2-naphthalen-2-yl-2-oxidanylidene-ethyl)-(4-nitrophenyl)sulfonyl-amino]-3-phenyl-propanoic acid

Systemtic Name: (2S)-2-[(2-naphthalen-2-yl-2-oxidanylidene-ethyl)-(4-nitrophenyl)sulfonyl-amino]-3-phenyl-propanoic acid Openeye Name: (2S)-2-[[2-(2-naphthyl)-2-oxo-ethyl]-(4-nitrophenyl)sulfonyl-amino]-3-phenyl-propanoic acid CAS Name: (2S)-2-[[2-(2-naphthalenyl)-2-oxoethyl]-(4-nitrophenyl)sulfonylamino]-3-phenylpropanoic acid IUPAC Name: (2S)-2-[(2-naphthalen-2-yl-2-oxoethyl)-(4-nitrophenyl)sulfonylamino]-3-phenylpropanoic acid Traditional Name: (2S)-2-[[2-keto-2-(2-naphthyl)ethyl]-nosyl-amino]-3-phenyl-propionic acid Formula: C27H22N2O7S MolecularWeight: 518.53778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)O)N(CC(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)O)N(CC(=O)C2=CC3=CC=CC=C3C=C2)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C27H22N2O7S/c30-26(22-11-10-20-8-4-5-9-21(20)17-22)18-28(25(27(31)32)16-19-6-2-1-3-7-19)37(35,36)24-14-12-23(13-15-24)29(33)34/h1-15,17,25H,16,18H2,(H,31,32)/t25-/m0/s1