(4-methoxyphenyl)methyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: (4-methoxyphenyl)methyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: (4-methoxyphenyl)methyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S)-4-(4-ethylphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid (4-methoxyphenyl)methyl ester IUPAC Name: (4-methoxyphenyl)methyl (4S)-4-(4-ethylphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S)-4-(4-ethylphenyl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid p-anisyl ester Formula: C27H29NO4 MolecularWeight: 431.52346

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2C3C(=NC(=C2C(=O)OCC4=CC=C(C=C4)OC)C)CCCC3=O

Isomeric SMILES

CCC1=CC=C(C=C1)[C@@H]2C3C(=NC(=C2C(=O)OCC4=CC=C(C=C4)OC)C)CCCC3=O

InChI

InChI=1S/C27H29NO4/c1-4-18-8-12-20(13-9-18)25-24(17(2)28-22-6-5-7-23(29)26(22)25)27(30)32-16-19-10-14-21(31-3)15-11-19/h8-15,25-26H,4-7,16H2,1-3H3/t25-,26?/m0/s1