methyl 4-[(Z)-[[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]hydrazinylidene]methyl]benzoate

Systemtic Name: methyl 4-[(Z)-[[3-(3-methoxypropyl)-4-oxidanylidene-quinazolin-2-yl]hydrazinylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[[3-(3-methoxypropyl)-4-oxo-quinazolin-2-yl]hydrazono]methyl]benzoate CAS Name: 4-[(Z)-[[3-(3-methoxypropyl)-4-oxo-2-quinazolinyl]hydrazinylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[[3-(3-methoxypropyl)-4-oxoquinazolin-2-yl]hydrazinylidene]methyl]benzoate Traditional Name: 4-[(Z)-[[4-keto-3-(3-methoxypropyl)quinazolin-2-yl]hydrazono]methyl]benzoic acid methyl ester Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=CC=CC=C2N=C1NN=CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

COCCCN1C(=O)C2=CC=CC=C2N=C1N/N=C\C3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C21H22N4O4/c1-28-13-5-12-25-19(26)17-6-3-4-7-18(17)23-21(25)24-22-14-15-8-10-16(11-9-15)20(27)29-2/h3-4,6-11,14H,5,12-13H2,1-2H3,(H,23,24)/b22-14-