methyl 2-[(cyclohexylmethylamino)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(cyclohexylmethylamino)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(cyclohexylmethylamino)methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(cyclohexylmethylamino)methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(cyclohexylmethylamino)methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(cyclohexylmethylamino)methyl]-4-keto-1H-quinazoline-7-carboxylic acid methyl ester Formula: C18H23N3O3 MolecularWeight: 329.39352

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CNCC3CCCCC3

Isomeric SMILES

COC(=O)C1=CC2=C(C=C1)C(=O)N=C(N2)CNCC3CCCCC3

InChI

InChI=1S/C18H23N3O3/c1-24-18(23)13-7-8-14-15(9-13)20-16(21-17(14)22)11-19-10-12-5-3-2-4-6-12/h7-9,12,19H,2-6,10-11H2,1H3,(H,20,21,22)