ethyl (3S,4R)-4-(2-ethoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate

Systemtic Name: ethyl (3S,4R)-4-(2-ethoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: ethyl (3S,4R)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (3S,4R)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl (3S,4R)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (3S,4R)-5-keto-2-methyl-4-o-phenetyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid ethyl ester Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1C2C(C(=NC3=C2C(=O)CCC3)C)C(=O)OCC

Isomeric SMILES

CCOC1=CC=CC=C1[C@H]2[C@@H](C(=NC3=C2C(=O)CCC3)C)C(=O)OCC

InChI

InChI=1S/C21H25NO4/c1-4-25-17-12-7-6-9-14(17)19-18(21(24)26-5-2)13(3)22-15-10-8-11-16(23)20(15)19/h6-7,9,12,18-19H,4-5,8,10-11H2,1-3H3/t18-,19+/m1/s1