(3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate

Systemtic Name: (3-methoxycarbonyl-4-methyl-quinolin-2-yl)methyl 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (3-methoxycarbonyl-4-methyl-2-quinolyl)methyl 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate CAS Name: 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid (3-methoxycarbonyl-4-methyl-2-quinolinyl)methyl ester IUPAC Name: (3-methoxycarbonyl-4-methylquinolin-2-yl)methyl 9-oxo-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Traditional Name: 9-keto-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylic acid (3-carbomethoxy-4-methyl-2-quinolyl)methyl ester Formula: C25H21N3O5 MolecularWeight: 443.45134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)COC(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4)C(=O)OC

InChI

InChI=1S/C25H21N3O5/c1-14-16-6-3-4-7-18(16)26-20(22(14)25(31)32-2)13-33-24(30)15-9-10-17-19(12-15)27-21-8-5-11-28(21)23(17)29/h3-4,6-7,9-10,12H,5,8,11,13H2,1-2H3