4,6-bis(chloranyl)-3-(3-oxidanylidene-3-phenylazanyl-prop-1-en-2-yl)-2-phenyl-indole-2-carboxylic acid

Systemtic Name: 4,6-bis(chloranyl)-3-(3-oxidanylidene-3-phenylazanyl-prop-1-en-2-yl)-2-phenyl-indole-2-carboxylic acid Openeye Name: 4,6-dichloro-2-phenyl-3-[1-(phenylcarbamoyl)vinyl]indole-2-carboxylic acid CAS Name: 3-(3-anilino-3-oxoprop-1-en-2-yl)-4,6-dichloro-2-phenyl-2-indolecarboxylic acid IUPAC Name: 3-(3-anilino-3-oxoprop-1-en-2-yl)-4,6-dichloro-2-phenylindole-2-carboxylic acid Traditional Name: 4,6-dichloro-2-phenyl-3-[1-(phenylcarbamoyl)vinyl]indole-2-carboxylic acid Formula: C24H16Cl2N2O3 MolecularWeight: 451.30144

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=C2C(=CC(=CC2=NC1(C3=CC=CC=C3)C(=O)O)Cl)Cl)C(=O)NC4=CC=CC=C4

Isomeric SMILES

C=C(C1=C2C(=CC(=CC2=NC1(C3=CC=CC=C3)C(=O)O)Cl)Cl)C(=O)NC4=CC=CC=C4

InChI

InChI=1S/C24H16Cl2N2O3/c1-14(22(29)27-17-10-6-3-7-11-17)21-20-18(26)12-16(25)13-19(20)28-24(21,23(30)31)15-8-4-2-5-9-15/h2-13H,1H2,(H,27,29)(H,30,31)