6-[C-(3,4-diaminocarbonylphenyl)carbonimidoyl]-2,3-bis(prop-2-enoyloxycarbamoyl)benzoic acid

Systemtic Name: 6-[C-(3,4-diaminocarbonylphenyl)carbonimidoyl]-2,3-bis(prop-2-enoyloxycarbamoyl)benzoic acid Openeye Name: 6-(3,4-dicarbamoylbenzenecarboximidoyl)-2,3-bis(prop-2-enoyloxycarbamoyl)benzoic acid CAS Name: 6-[(3,4-dicarbamoylphenyl)-iminomethyl]-2,3-bis[oxo-(1-oxoprop-2-enoxyamino)methyl]benzoic acid IUPAC Name: 6-(3,4-dicarbamoylbenzenecarboximidoyl)-2,3-bis(prop-2-enoyloxycarbamoyl)benzoic acid Traditional Name: 2,3-bis(acryloyloxycarbamoyl)-6-(3,4-dicarbamoylbenzimidoyl)benzoic acid Formula: C24H19N5O10 MolecularWeight: 537.43516

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Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)ONC(=O)C1=C(C(=C(C=C1)C(=N)C2=CC(=C(C=C2)C(=O)N)C(=O)N)C(=O)O)C(=O)NOC(=O)C=C

Isomeric SMILES

C=CC(=O)ONC(=O)C1=C(C(=C(C=C1)C(=N)C2=CC(=C(C=C2)C(=O)N)C(=O)N)C(=O)O)C(=O)NOC(=O)C=C

InChI

InChI=1S/C24H19N5O10/c1-3-15(30)38-28-22(34)13-8-7-12(18(24(36)37)17(13)23(35)29-39-16(31)4-2)19(25)10-5-6-11(20(26)32)14(9-10)21(27)33/h3-9,25H,1-2H2,(H2,26,32)(H2,27,33)(H,28,34)(H,29,35)(H,36,37)