methyl (4S)-4-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carboxylate

Systemtic Name: methyl (4S)-4-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxidanylidene-3,4,6,8-tetrahydroquinoline-3-carboxylate Openeye Name: methyl (4S)-4-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate CAS Name: (4S)-4-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-4-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2,7,7-trimethyl-5-oxo-3,4,6,8-tetrahydroquinoline-3-carboxylate Traditional Name: (4S)-5-keto-4-[5-(4-methoxyphenyl)-1H-pyrazol-4-yl]-2,7,7-trimethyl-3,4,6,8-tetrahydroquinoline-3-carboxylic acid methyl ester Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(C(C1C(=O)OC)C3=C(NN=C3)C4=CC=C(C=C4)OC)C(=O)CC(C2)(C)C

Isomeric SMILES

CC1=NC2=C([C@@H](C1C(=O)OC)C3=C(NN=C3)C4=CC=C(C=C4)OC)C(=O)CC(C2)(C)C

InChI

InChI=1S/C24H27N3O4/c1-13-19(23(29)31-5)20(21-17(26-13)10-24(2,3)11-18(21)28)16-12-25-27-22(16)14-6-8-15(30-4)9-7-14/h6-9,12,19-20H,10-11H2,1-5H3,(H,25,27)/t19?,20-/m1/s1