6-chloranyl-2-[(E)-ethylideneamino]-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-2-[(E)-ethylideneamino]-1-oxidanylidene-4-phenyl-isoquinoline-3-carboxylic acid Openeye Name: 6-chloro-2-[(E)-ethylideneamino]-1-oxo-4-phenyl-isoquinoline-3-carboxylic acid CAS Name: 6-chloro-2-[(E)-ethylideneamino]-1-oxo-4-phenyl-3-isoquinolinecarboxylic acid IUPAC Name: 6-chloro-2-[(E)-ethylideneamino]-1-oxo-4-phenylisoquinoline-3-carboxylic acid Traditional Name: 6-chloro-2-[(E)-ethylideneamino]-1-keto-4-phenyl-isoquinoline-3-carboxylic acid Formula: C18H13ClN2O3 MolecularWeight: 340.76042

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Descriptors Computed from Structure

Canonical SMILES:

CC=NN1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)C(=O)O

Isomeric SMILES

C/C=N/N1C(=C(C2=C(C1=O)C=CC(=C2)Cl)C3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C18H13ClN2O3/c1-2-20-21-16(18(23)24)15(11-6-4-3-5-7-11)14-10-12(19)8-9-13(14)17(21)22/h2-10H,1H3,(H,23,24)/b20-2+