methyl 2-[[(3,4-dimethoxyphenyl)methyl-ethyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[[(3,4-dimethoxyphenyl)methyl-ethyl-amino]methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[[(3,4-dimethoxyphenyl)methyl-ethyl-amino]methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[[(3,4-dimethoxyphenyl)methyl-ethylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[[(3,4-dimethoxyphenyl)methyl-ethylamino]methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[[ethyl(veratryl)amino]methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC(=C(C=C1)OC)OC)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

Isomeric SMILES

CCN(CC1=CC(=C(C=C1)OC)OC)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC

InChI

InChI=1S/C22H25N3O5/c1-5-25(12-14-6-9-18(28-2)19(10-14)29-3)13-20-23-17-11-15(22(27)30-4)7-8-16(17)21(26)24-20/h6-11H,5,12-13H2,1-4H3,(H,23,24,26)