methyl 2,7,7-trimethyl-5-oxidanylidene-4-(4-pentan-3-ylphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl 2,7,7-trimethyl-5-oxidanylidene-4-(4-pentan-3-ylphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl 4-[4-(1-ethylpropyl)phenyl]-2,7,7-trimethyl-5-oxo-1,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: 2,7,7-trimethyl-5-oxo-4-(4-pentan-3-ylphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 2,7,7-trimethyl-5-oxo-4-(4-pentan-3-ylphenyl)-1,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: 4-[4-(1-ethylpropyl)phenyl]-5-keto-2,7,7-trimethyl-1,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C25H33NO3 MolecularWeight: 395.53442

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC)C

Isomeric SMILES

CCC(CC)C1=CC=C(C=C1)C2C3=C(CC(CC3=O)(C)C)NC(=C2C(=O)OC)C

InChI

InChI=1S/C25H33NO3/c1-7-16(8-2)17-9-11-18(12-10-17)22-21(24(28)29-6)15(3)26-19-13-25(4,5)14-20(27)23(19)22/h9-12,16,22,26H,7-8,13-14H2,1-6H3