disodium 2-[[2-[(2-carboxylatophenyl)carbamoyl]-3-phenyl-prop-2-enoyl]amino]benzoate

Systemtic Name: disodium 2-[[2-[(2-carboxylatophenyl)carbamoyl]-3-phenyl-prop-2-enoyl]amino]benzoate Openeye Name: disodium 2-[[2-[(2-carboxylatophenyl)carbamoyl]-3-phenyl-prop-2-enoyl]amino]benzoate CAS Name: disodium 2-[[2-[(2-carboxylatoanilino)-oxomethyl]-1-oxo-3-phenylprop-2-enyl]amino]benzoate IUPAC Name: disodium 2-[[2-[(2-carboxylatophenyl)carbamoyl]-3-phenylprop-2-enoyl]amino]benzoate Traditional Name: disodium 2-[[2-[(2-carboxylatophenyl)carbamoyl]-3-phenyl-acryloyl]amino]benzoate Formula: C24H16N2Na2O6 MolecularWeight: 474.37318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=C(C(=O)NC2=CC=CC=C2C(=O)[O-])C(=O)NC3=CC=CC=C3C(=O)[O-].[Na+].[Na+]

Isomeric SMILES

C1=CC=C(C=C1)C=C(C(=O)NC2=CC=CC=C2C(=O)[O-])C(=O)NC3=CC=CC=C3C(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C24H18N2O6.2Na/c27-21(25-19-12-6-4-10-16(19)23(29)30)18(14-15-8-2-1-3-9-15)22(28)26-20-13-7-5-11-17(20)24(31)32;;/h1-14H,(H,25,27)(H,26,28)(H,29,30)(H,31,32);;/q;2*+1/p-2