methyl 4-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoate

Systemtic Name: methyl 4-[(4-oxidanylidene-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoate Openeye Name: methyl 4-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoate CAS Name: 4-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-[(4-oxo-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoate Traditional Name: 4-[(4-keto-5,6,7,8-tetrahydro-1H-quinazolin-2-yl)amino]benzoic acid methyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC2=NC(=O)C3=C(N2)CCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NC2=NC(=O)C3=C(N2)CCCC3

InChI

InChI=1S/C16H17N3O3/c1-22-15(21)10-6-8-11(9-7-10)17-16-18-13-5-3-2-4-12(13)14(20)19-16/h6-9H,2-5H2,1H3,(H2,17,18,19,20)