(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 3-methyl-2-phenyl-quinoline-4-carboxylate CAS Name: 3-methyl-2-phenyl-4-quinolinecarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 3-methyl-2-phenylquinoline-4-carboxylate Traditional Name: 3-methyl-2-phenyl-cinchoninic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C29H23NO4 MolecularWeight: 449.49722

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC=CC=C5)C)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=C(C(=NC4=CC=CC=C43)C5=CC=CC=C5)C)C

InChI

InChI=1S/C29H23NO4/c1-17-13-14-22-21(15-25(31)34-28(22)18(17)2)16-33-29(32)26-19(3)27(20-9-5-4-6-10-20)30-24-12-8-7-11-23(24)26/h4-15H,16H2,1-3H3