methyl 4-[2-(2-hydroxyethyloxy)ethylamino]-2-(pyridin-3-ylmethyl)quinazoline-6-carboxylate

Systemtic Name: methyl 4-[2-(2-hydroxyethyloxy)ethylamino]-2-(pyridin-3-ylmethyl)quinazoline-6-carboxylate Openeye Name: methyl 4-[2-(2-hydroxyethoxy)ethylamino]-2-(3-pyridylmethyl)quinazoline-6-carboxylate CAS Name: 4-[2-(2-hydroxyethoxy)ethylamino]-2-(3-pyridinylmethyl)-6-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(2-hydroxyethoxy)ethylamino]-2-(pyridin-3-ylmethyl)quinazoline-6-carboxylate Traditional Name: 4-[2-(2-hydroxyethoxy)ethylamino]-2-(3-pyridylmethyl)quinazoline-6-carboxylic acid methyl ester Formula: C20H22N4O4 MolecularWeight: 382.41308

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)N=C(N=C2NCCOCCO)CC3=CN=CC=C3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)N=C(N=C2NCCOCCO)CC3=CN=CC=C3

InChI

InChI=1S/C20H22N4O4/c1-27-20(26)15-4-5-17-16(12-15)19(22-7-9-28-10-8-25)24-18(23-17)11-14-3-2-6-21-13-14/h2-6,12-13,25H,7-11H2,1H3,(H,22,23,24)