methyl 2-[(3,5-dimethylpiperidin-1-yl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: methyl 2-[(3,5-dimethylpiperidin-1-yl)methyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: methyl 2-[(3,5-dimethyl-1-piperidyl)methyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(3,5-dimethyl-1-piperidinyl)methyl]-4-oxo-1H-quinazoline-7-carboxylic acid methyl ester IUPAC Name: methyl 2-[(3,5-dimethylpiperidin-1-yl)methyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(3,5-dimethylpiperidino)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:

CC1CC(CN(C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C

Isomeric SMILES

CC1CC(CN(C1)CC2=NC(=O)C3=C(N2)C=C(C=C3)C(=O)OC)C

InChI

InChI=1S/C18H23N3O3/c1-11-6-12(2)9-21(8-11)10-16-19-15-7-13(18(23)24-3)4-5-14(15)17(22)20-16/h4-5,7,11-12H,6,8-10H2,1-3H3,(H,19,20,22)