dimethyl (4S)-4-(2,5-dimethylphenyl)-3,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: dimethyl (4S)-4-(2,5-dimethylphenyl)-3,4-dihydropyridine-3,5-dicarboxylate Openeye Name: dimethyl (4S)-4-(2,5-dimethylphenyl)-3,4-dihydropyridine-3,5-dicarboxylate CAS Name: (4S)-4-(2,5-dimethylphenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (4S)-4-(2,5-dimethylphenyl)-3,4-dihydropyridine-3,5-dicarboxylate Traditional Name: (4S)-4-(2,5-dimethylphenyl)-3,4-dihydropyridine-3,5-dicarboxylic acid dimethyl ester Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)C2C(C=NC=C2C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=CC(=C(C=C1)C)[C@@H]2C(C=NC=C2C(=O)OC)C(=O)OC

InChI

InChI=1S/C17H19NO4/c1-10-5-6-11(2)12(7-10)15-13(16(19)21-3)8-18-9-14(15)17(20)22-4/h5-9,13,15H,1-4H3/t13?,15-/m1/s1