O3,O5-dimethyl O4-(quinolin-2-ylmethyl) (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate

Systemtic Name: O3,O5-dimethyl O4-(quinolin-2-ylmethyl) (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate Openeye Name: O3,O5-dimethyl O4-(2-quinolylmethyl) (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate CAS Name: (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O3,O5-dimethyl ester O4-(2-quinolinylmethyl) ester IUPAC Name: 3-O,5-O-dimethyl 4-O-(quinolin-2-ylmethyl) (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylate Traditional Name: (4S)-2,6-dimethyl-3,4-dihydropyridine-3,4,5-tricarboxylic acid O3,O5-dimethyl ester O4-(2-quinolylmethyl) ester Formula: C22H22N2O6 MolecularWeight: 410.41988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=C(C(C1C(=O)OC)C(=O)OCC2=NC3=CC=CC=C3C=C2)C(=O)OC)C

Isomeric SMILES

CC1=NC(=C([C@H](C1C(=O)OC)C(=O)OCC2=NC3=CC=CC=C3C=C2)C(=O)OC)C

InChI

InChI=1S/C22H22N2O6/c1-12-17(20(25)28-3)19(18(13(2)23-12)21(26)29-4)22(27)30-11-15-10-9-14-7-5-6-8-16(14)24-15/h5-10,17,19H,11H2,1-4H3/t17?,19-/m0/s1