2-[[3-methoxy-2-[(2-nitrophenyl)sulfonylamino]propanoyl]amino]-3-naphthalen-2-yl-propanoic acid

Systemtic Name: 2-[[3-methoxy-2-[(2-nitrophenyl)sulfonylamino]propanoyl]amino]-3-naphthalen-2-yl-propanoic acid Openeye Name: 2-[[3-methoxy-2-[(2-nitrophenyl)sulfonylamino]propanoyl]amino]-3-(2-naphthyl)propanoic acid CAS Name: 2-[[3-methoxy-2-[(2-nitrophenyl)sulfonylamino]-1-oxopropyl]amino]-3-(2-naphthalenyl)propanoic acid IUPAC Name: 2-[[3-methoxy-2-[(2-nitrophenyl)sulfonylamino]propanoyl]amino]-3-naphthalen-2-ylpropanoic acid Traditional Name: 2-[[3-methoxy-2-[(2-nitrophenyl)sulfonylamino]propanoyl]amino]-3-(2-naphthyl)propionic acid Formula: C23H23N3O8S MolecularWeight: 501.50902

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Descriptors Computed from Structure

Canonical SMILES:

COCC(C(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

COCC(C(=O)NC(CC1=CC2=CC=CC=C2C=C1)C(=O)O)NS(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C23H23N3O8S/c1-34-14-19(25-35(32,33)21-9-5-4-8-20(21)26(30)31)22(27)24-18(23(28)29)13-15-10-11-16-6-2-3-7-17(16)12-15/h2-12,18-19,25H,13-14H2,1H3,(H,24,27)(H,28,29)