(7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl quinoline-2-carboxylate

Systemtic Name: (7-methyl-2-oxidanylidene-6-propan-2-yl-chromen-4-yl)methyl quinoline-2-carboxylate Openeye Name: (6-isopropyl-7-methyl-2-oxo-chromen-4-yl)methyl quinoline-2-carboxylate CAS Name: 2-quinolinecarboxylic acid (7-methyl-2-oxo-6-propan-2-yl-1-benzopyran-4-yl)methyl ester IUPAC Name: (7-methyl-2-oxo-6-propan-2-ylchromen-4-yl)methyl quinoline-2-carboxylate Traditional Name: quinaldic acid (6-isopropyl-2-keto-7-methyl-chromen-4-yl)methyl ester Formula: C24H21NO4 MolecularWeight: 387.42784

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=NC4=CC=CC=C4C=C3)C(C)C

Isomeric SMILES

CC1=C(C=C2C(=CC(=O)OC2=C1)COC(=O)C3=NC4=CC=CC=C4C=C3)C(C)C

InChI

InChI=1S/C24H21NO4/c1-14(2)18-12-19-17(11-23(26)29-22(19)10-15(18)3)13-28-24(27)21-9-8-16-6-4-5-7-20(16)25-21/h4-12,14H,13H2,1-3H3