(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-pyrrol-1-ylbenzoate

Systemtic Name: (6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl 3-pyrrol-1-ylbenzoate Openeye Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 3-pyrrol-1-ylbenzoate CAS Name: 3-(1-pyrrolyl)benzoic acid (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl ester IUPAC Name: (6-chloro-4-oxo-1H-quinazolin-2-yl)methyl 3-pyrrol-1-ylbenzoate Traditional Name: 3-pyrrol-1-ylbenzoic acid (6-chloro-4-keto-1H-quinazolin-2-yl)methyl ester Formula: C20H14ClN3O3 MolecularWeight: 379.79646

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(C=C1)C2=CC=CC(=C2)C(=O)OCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

C1=CN(C=C1)C2=CC=CC(=C2)C(=O)OCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C20H14ClN3O3/c21-14-6-7-17-16(11-14)19(25)23-18(22-17)12-27-20(26)13-4-3-5-15(10-13)24-8-1-2-9-24/h1-11H,12H2,(H,22,23,25)