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

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 9-oxidanylidene-2,3-dihydro-1H-pyrrolo[2,1-b]quinazoline-6-carboxylate Openeye Name: [4-(phenylcarbamoyl)phenyl]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 [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]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 [4-(phenylcarbamoyl)benzyl] ester Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=NC3=C(C=CC(=C3)C(=O)OCC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5)C(=O)N2C1

Isomeric SMILES

C1CC2=NC3=C(C=CC(=C3)C(=O)OCC4=CC=C(C=C4)C(=O)NC5=CC=CC=C5)C(=O)N2C1

InChI

InChI=1S/C26H21N3O4/c30-24(27-20-5-2-1-3-6-20)18-10-8-17(9-11-18)16-33-26(32)19-12-13-21-22(15-19)28-23-7-4-14-29(23)25(21)31/h1-3,5-6,8-13,15H,4,7,14,16H2,(H,27,30)