ethyl 4-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylate

Systemtic Name: ethyl 4-[(6-chloranyl-4-oxidanylidene-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylate Openeye Name: ethyl 4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(6-chloro-4-oxo-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(6-chloro-4-keto-1H-quinazolin-2-yl)methyl]piperazine-1-carboxylic acid ethyl ester Formula: C16H19ClN4O3 MolecularWeight: 350.80006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

Isomeric SMILES

CCOC(=O)N1CCN(CC1)CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl

InChI

InChI=1S/C16H19ClN4O3/c1-2-24-16(23)21-7-5-20(6-8-21)10-14-18-13-4-3-11(17)9-12(13)15(22)19-14/h3-4,9H,2,5-8,10H2,1H3,(H,18,19,22)