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

Systemtic Name: (3-methylquinoxalin-2-yl)methyl 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: (3-methylquinoxalin-2-yl)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-methyl-2-quinoxalinyl)methyl ester IUPAC Name: (3-methylquinoxalin-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-methylquinoxalin-2-yl)methyl ester Formula: C22H18N4O3 MolecularWeight: 386.40332

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4

Isomeric SMILES

CC1=NC2=CC=CC=C2N=C1COC(=O)C3=CC4=C(C=C3)C(=O)N5CCCC5=N4

InChI

InChI=1S/C22H18N4O3/c1-13-19(24-17-6-3-2-5-16(17)23-13)12-29-22(28)14-8-9-15-18(11-14)25-20-7-4-10-26(20)21(15)27/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3