[2-(4-tert-butylphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] pyridine-3-carboxylate

Systemtic Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxidanylidene-chromen-3-yl] pyridine-3-carboxylate Openeye Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxo-chromen-3-yl] pyridine-3-carboxylate CAS Name: 3-pyridinecarboxylic acid [2-(4-tert-butylphenyl)-7-methyl-4-oxo-1-benzopyran-3-yl] ester IUPAC Name: [2-(4-tert-butylphenyl)-7-methyl-4-oxochromen-3-yl] pyridine-3-carboxylate Traditional Name: nicotinic acid [2-(4-tert-butylphenyl)-4-keto-7-methyl-chromen-3-yl] ester Formula: C26H23NO4 MolecularWeight: 413.46512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OC(=O)C4=CN=CC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)C(=O)C(=C(O2)C3=CC=C(C=C3)C(C)(C)C)OC(=O)C4=CN=CC=C4

InChI

InChI=1S/C26H23NO4/c1-16-7-12-20-21(14-16)30-23(17-8-10-19(11-9-17)26(2,3)4)24(22(20)28)31-25(29)18-6-5-13-27-15-18/h5-15H,1-4H3