methyl 3-[3-(2,3-dihydroindol-1-yl)propyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[3-(2,3-dihydroindol-1-yl)propyl]-2,4-bis(oxidanylidene)-1H-quinazoline-7-carboxylate Openeye Name: methyl 3-(3-indolin-1-ylpropyl)-2,4-dioxo-1H-quinazoline-7-carboxylate CAS Name: 3-[3-(2,3-dihydroindol-1-yl)propyl]-2,4-dioxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 3-[3-(2,3-dihydroindol-1-yl)propyl]-2,4-dioxo-1H-quinazoline-7-carboxylate Traditional Name: 3-(3-indolin-1-ylpropyl)-2,4-diketo-1H-quinazoline-7-carboxylic acid methyl ester Formula: C21H21N3O4 MolecularWeight: 379.40914

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCCN3CCC4=CC=CC=C43

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N(C(=O)N2)CCCN3CCC4=CC=CC=C43

InChI

InChI=1S/C21H21N3O4/c1-28-20(26)15-7-8-16-17(13-15)22-21(27)24(19(16)25)11-4-10-23-12-9-14-5-2-3-6-18(14)23/h2-3,5-8,13H,4,9-12H2,1H3,(H,22,27)