methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-quinazoline-7-carboxylate

Systemtic Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxidanylidene-ethyl]-4-oxidanylidene-quinazoline-7-carboxylate Openeye Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxo-ethyl]-4-oxo-quinazoline-7-carboxylate CAS Name: 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-4-oxo-7-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 3-[2-[2-(3,4-dimethoxyphenyl)ethylamino]-2-oxoethyl]-4-oxoquinazoline-7-carboxylate Traditional Name: 3-[2-(homoveratrylamino)-2-keto-ethyl]-4-keto-quinazoline-7-carboxylic acid methyl ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCNC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCNC(=O)CN2C=NC3=C(C2=O)C=CC(=C3)C(=O)OC)OC

InChI

InChI=1S/C22H23N3O6/c1-29-18-7-4-14(10-19(18)30-2)8-9-23-20(26)12-25-13-24-17-11-15(22(28)31-3)5-6-16(17)21(25)27/h4-7,10-11,13H,8-9,12H2,1-3H3,(H,23,26)