6-(2-chlorophenyl)-7-oxidanylidene-2-(propan-2-ylamino)-1H-quinazoline-8-carboxylic acid

Systemtic Name: 6-(2-chlorophenyl)-7-oxidanylidene-2-(propan-2-ylamino)-1H-quinazoline-8-carboxylic acid Openeye Name: 6-(2-chlorophenyl)-2-(isopropylamino)-7-oxo-1H-quinazoline-8-carboxylic acid CAS Name: 6-(2-chlorophenyl)-7-oxo-2-(propan-2-ylamino)-1H-quinazoline-8-carboxylic acid IUPAC Name: 6-(2-chlorophenyl)-7-oxo-2-(propan-2-ylamino)-1H-quinazoline-8-carboxylic acid Traditional Name: 6-(2-chlorophenyl)-2-(isopropylamino)-7-keto-1H-quinazoline-8-carboxylic acid Formula: C18H16ClN3O3 MolecularWeight: 357.79094

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=NC=C2C=C(C(=O)C(=C2N1)C(=O)O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)NC1=NC=C2C=C(C(=O)C(=C2N1)C(=O)O)C3=CC=CC=C3Cl

InChI

InChI=1S/C18H16ClN3O3/c1-9(2)21-18-20-8-10-7-12(11-5-3-4-6-13(11)19)16(23)14(17(24)25)15(10)22-18/h3-9H,1-2H3,(H,24,25)(H2,20,21,22)