(4-oxidanylidene-1H-quinazolin-2-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate

Systemtic Name: (4-oxidanylidene-1H-quinazolin-2-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Openeye Name: (4-oxo-1H-quinazolin-2-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate CAS Name: 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid (4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (4-oxo-1H-quinazolin-2-yl)methyl 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylate Traditional Name: 7,8,9,10-tetrahydro-6H-cyclohepta[b]quinoline-11-carboxylic acid (4-keto-1H-quinazolin-2-yl)methyl ester Formula: C24H21N3O3 MolecularWeight: 399.44184

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C3=CC=CC=C3N=C2CC1)C(=O)OCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1CCC2=C(C3=CC=CC=C3N=C2CC1)C(=O)OCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C24H21N3O3/c28-23-17-10-5-7-13-20(17)26-21(27-23)14-30-24(29)22-15-8-2-1-3-11-18(15)25-19-12-6-4-9-16(19)22/h4-7,9-10,12-13H,1-3,8,11,14H2,(H,26,27,28)