pyridin-4-ylmethyl 2,4-bis(oxidanylidene)-3-(phenylmethyl)-1H-quinazoline-6-carboxylate

Systemtic Name: pyridin-4-ylmethyl 2,4-bis(oxidanylidene)-3-(phenylmethyl)-1H-quinazoline-6-carboxylate Openeye Name: 4-pyridylmethyl 3-benzyl-2,4-dioxo-1H-quinazoline-6-carboxylate CAS Name: 2,4-dioxo-3-(phenylmethyl)-1H-quinazoline-6-carboxylic acid pyridin-4-ylmethyl ester IUPAC Name: pyridin-4-ylmethyl 3-benzyl-2,4-dioxo-1H-quinazoline-6-carboxylate Traditional Name: 3-benzyl-2,4-diketo-1H-quinazoline-6-carboxylic acid 4-pyridylmethyl ester Formula: C22H17N3O4 MolecularWeight: 387.38808

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)C(=O)OCC4=CC=NC=C4)NC2=O

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=O)C3=C(C=CC(=C3)C(=O)OCC4=CC=NC=C4)NC2=O

InChI

InChI=1S/C22H17N3O4/c26-20-18-12-17(21(27)29-14-16-8-10-23-11-9-16)6-7-19(18)24-22(28)25(20)13-15-4-2-1-3-5-15/h1-12H,13-14H2,(H,24,28)