ethyl (4S)-4-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate

Systemtic Name: ethyl (4S)-4-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxidanylidene-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Openeye Name: ethyl (4S)-4-(4-ethoxy-3-methoxy-phenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate CAS Name: (4S)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl (4S)-4-(4-ethoxy-3-methoxyphenyl)-2-methyl-5-oxo-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylate Traditional Name: (4S)-4-(4-ethoxy-3-methoxy-phenyl)-5-keto-2-methyl-4a,6,7,8-tetrahydro-4H-quinoline-3-carboxylic acid ethyl ester Formula: C22H27NO5 MolecularWeight: 385.45348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C2C3C(=NC(=C2C(=O)OCC)C)CCCC3=O)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1)[C@@H]2C3C(=NC(=C2C(=O)OCC)C)CCCC3=O)OC

InChI

InChI=1S/C22H27NO5/c1-5-27-17-11-10-14(12-18(17)26-4)20-19(22(25)28-6-2)13(3)23-15-8-7-9-16(24)21(15)20/h10-12,20-21H,5-9H2,1-4H3/t20-,21?/m0/s1