methyl 4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl 4-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)-2,7,7-trimethyl-5-oxidanylidene-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 4-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(N(N=C3C)C4=CC=CC=C4)Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)CC(CC2=O)(C)C)C3=C(N(N=C3C)C4=CC=CC=C4)Cl)C(=O)OC

InChI

InChI=1S/C24H26ClN3O3/c1-13-19(23(30)31-5)21(20-16(26-13)11-24(3,4)12-17(20)29)18-14(2)27-28(22(18)25)15-9-7-6-8-10-15/h6-10,21,26H,11-12H2,1-5H3