4-(3-acetamido-5-oxidanylidene-1-phenyl-2H-pyrrol-4-yl)-7-chloranyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid

Systemtic Name: 4-(3-acetamido-5-oxidanylidene-1-phenyl-2H-pyrrol-4-yl)-7-chloranyl-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Openeye Name: 4-(3-acetamido-5-oxo-1-phenyl-2H-pyrrol-4-yl)-7-chloro-1,2,3,4-tetrahydroquinoline-2-carboxylic acid CAS Name: 4-(3-acetamido-5-oxo-1-phenyl-2H-pyrrol-4-yl)-7-chloro-1,2,3,4-tetrahydroquinoline-2-carboxylic acid IUPAC Name: 4-(3-acetamido-5-oxo-1-phenyl-2H-pyrrol-4-yl)-7-chloro-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Traditional Name: 4-(4-acetamido-2-keto-1-phenyl-3-pyrrolin-3-yl)-7-chloro-1,2,3,4-tetrahydroquinoline-2-carboxylic acid Formula: C22H20ClN3O4 MolecularWeight: 425.8649

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=C(C(=O)N(C1)C2=CC=CC=C2)C3CC(NC4=C3C=CC(=C4)Cl)C(=O)O

Isomeric SMILES

CC(=O)NC1=C(C(=O)N(C1)C2=CC=CC=C2)C3CC(NC4=C3C=CC(=C4)Cl)C(=O)O

InChI

InChI=1S/C22H20ClN3O4/c1-12(27)24-19-11-26(14-5-3-2-4-6-14)21(28)20(19)16-10-18(22(29)30)25-17-9-13(23)7-8-15(16)17/h2-9,16,18,25H,10-11H2,1H3,(H,24,27)(H,29,30)