6-chloranyl-3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)-2-phenyl-indole-2-carboxylic acid

Systemtic Name: 6-chloranyl-3-(3-oxidanyl-3-oxidanylidene-prop-1-en-2-yl)-2-phenyl-indole-2-carboxylic acid Openeye Name: 3-(1-carboxyvinyl)-6-chloro-2-phenyl-indole-2-carboxylic acid CAS Name: 6-chloro-3-(3-hydroxy-3-oxoprop-1-en-2-yl)-2-phenyl-2-indolecarboxylic acid IUPAC Name: 6-chloro-3-(3-hydroxy-3-oxoprop-1-en-2-yl)-2-phenylindole-2-carboxylic acid Traditional Name: 3-(1-carboxyvinyl)-6-chloro-2-phenyl-indole-2-carboxylic acid Formula: C18H12ClNO4 MolecularWeight: 341.74518

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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)C(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C18H12ClNO4/c1-10(16(21)22)15-13-8-7-12(19)9-14(13)20-18(15,17(23)24)11-5-3-2-4-6-11/h2-9H,1H2,(H,21,22)(H,23,24)