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

Systemtic Name: methyl 4-[2-(2-hydroxyethyloxy)ethylamino]-2-[(E)-2-pyridin-3-ylethenyl]quinazoline-6-carboxylate Openeye Name: methyl 4-[2-(2-hydroxyethoxy)ethylamino]-2-[(E)-2-(3-pyridyl)vinyl]quinazoline-6-carboxylate CAS Name: 4-[2-(2-hydroxyethoxy)ethylamino]-2-[(E)-2-(3-pyridinyl)ethenyl]-6-quinazolinecarboxylic acid methyl ester IUPAC Name: methyl 4-[2-(2-hydroxyethoxy)ethylamino]-2-[(E)-2-pyridin-3-ylethenyl]quinazoline-6-carboxylate Traditional Name: 4-[2-(2-hydroxyethoxy)ethylamino]-2-[(E)-2-(3-pyridyl)vinyl]quinazoline-6-carboxylic acid methyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N4O4/c1-28-21(27)16-5-6-18-17(13-16)20(23-9-11-29-12-10-26)25-19(24-18)7-4-15-3-2-8-22-14-15/h2-8,13-14,26H,9-12H2,1H3,(H,23,24,25)/b7-4+