(6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1H-indole-2-carboxylate

Systemtic Name: (6,7-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 1H-indole-2-carboxylate Openeye Name: (6,7-dimethyl-2-oxo-chromen-4-yl)methyl 1H-indole-2-carboxylate CAS Name: 1H-indole-2-carboxylic acid (6,7-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (6,7-dimethyl-2-oxochromen-4-yl)methyl 1H-indole-2-carboxylate Traditional Name: 1H-indole-2-carboxylic acid (2-keto-6,7-dimethyl-chromen-4-yl)methyl ester Formula: C21H17NO4 MolecularWeight: 347.36398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC4=CC=CC=C4N3)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)COC(=O)C3=CC4=CC=CC=C4N3)C

InChI

InChI=1S/C21H17NO4/c1-12-7-16-15(10-20(23)26-19(16)8-13(12)2)11-25-21(24)18-9-14-5-3-4-6-17(14)22-18/h3-10,22H,11H2,1-2H3