3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-bis(oxidanylidene)quinazoline-1-carboxylic acid

Systemtic Name: 3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-bis(oxidanylidene)quinazoline-1-carboxylic acid Openeye Name: 3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-dioxo-quinazoline-1-carboxylic acid CAS Name: 3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-dioxo-1-quinazolinecarboxylic acid IUPAC Name: 3-(2-chlorophenyl)-6-ethoxycarbonyl-5,7-dimethyl-2,4-dioxoquinazoline-1-carboxylic acid Traditional Name: 6-carbethoxy-3-(2-chlorophenyl)-2,4-diketo-5,7-dimethyl-quinazoline-1-carboxylic acid Formula: C20H17ClN2O6 MolecularWeight: 416.81178

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=C1C)N(C(=O)N(C2=O)C3=CC=CC=C3Cl)C(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=C1C)N(C(=O)N(C2=O)C3=CC=CC=C3Cl)C(=O)O)C

InChI

InChI=1S/C20H17ClN2O6/c1-4-29-18(25)15-10(2)9-14-16(11(15)3)17(24)22(19(26)23(14)20(27)28)13-8-6-5-7-12(13)21/h5-9H,4H2,1-3H3,(H,27,28)