2-[[2-[(2-carboxyphenyl)carbamoyl]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoic acid

Systemtic Name: 2-[[2-[(2-carboxyphenyl)carbamoyl]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoic acid Openeye Name: 2-[[2-[(2-carboxyphenyl)carbamoyl]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoic acid CAS Name: 2-[[2-[(2-carboxyanilino)-oxomethyl]-3-(4-nitrophenyl)-1-oxoprop-2-enyl]amino]benzoic acid IUPAC Name: 2-[[2-[(2-carboxyphenyl)carbamoyl]-3-(4-nitrophenyl)prop-2-enoyl]amino]benzoic acid Traditional Name: 2-[[2-[(2-carboxyphenyl)carbamoyl]-3-(4-nitrophenyl)acryloyl]amino]benzoic acid Formula: C24H17N3O8 MolecularWeight: 475.40708

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)O)NC(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)O)NC(=O)C(=CC2=CC=C(C=C2)[N+](=O)[O-])C(=O)NC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C24H17N3O8/c28-21(25-19-7-3-1-5-16(19)23(30)31)18(13-14-9-11-15(12-10-14)27(34)35)22(29)26-20-8-4-2-6-17(20)24(32)33/h1-13H,(H,25,28)(H,26,29)(H,30,31)(H,32,33)