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

Systemtic Name: prop-2-enyl (3S,4S)-4-(2-ethoxyphenyl)-2-methyl-5-oxidanylidene-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Openeye Name: allyl (3S,4S)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate CAS Name: (3S,4S)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (3S,4S)-4-(2-ethoxyphenyl)-2-methyl-5-oxo-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylate Traditional Name: (3S,4S)-5-keto-2-methyl-4-o-phenetyl-4,6,7,8-tetrahydro-3H-quinoline-3-carboxylic acid allyl ester Formula: C22H25NO4 MolecularWeight: 367.4382

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H25NO4/c1-4-13-27-22(25)19-14(3)23-16-10-8-11-17(24)21(16)20(19)15-9-6-7-12-18(15)26-5-2/h4,6-7,9,12,19-20H,1,5,8,10-11,13H2,2-3H3/t19-,20-/m1/s1