2-[(Z)-1-chloranyl-2-(4-piperidin-1-ylphenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate

Systemtic Name: 2-[(Z)-1-chloranyl-2-(4-piperidin-1-ylphenyl)ethenyl]-4-oxidanylidene-1H-quinazoline-7-carboxylate Openeye Name: 2-[(Z)-1-chloro-2-[4-(1-piperidyl)phenyl]vinyl]-4-oxo-1H-quinazoline-7-carboxylate CAS Name: 2-[(Z)-1-chloro-2-[4-(1-piperidinyl)phenyl]ethenyl]-4-oxo-1H-quinazoline-7-carboxylate IUPAC Name: 2-[(Z)-1-chloro-2-(4-piperidin-1-ylphenyl)ethenyl]-4-oxo-1H-quinazoline-7-carboxylate Traditional Name: 2-[(Z)-1-chloro-2-(4-piperidinophenyl)vinyl]-4-keto-1H-quinazoline-7-carboxylate Formula: C22H19ClN3O3- MolecularWeight: 408.85756

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)C=C(C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)[O-])Cl

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)/C=C(/C3=NC(=O)C4=C(N3)C=C(C=C4)C(=O)[O-])\Cl

InChI

InChI=1S/C22H20ClN3O3/c23-18(12-14-4-7-16(8-5-14)26-10-2-1-3-11-26)20-24-19-13-15(22(28)29)6-9-17(19)21(27)25-20/h4-9,12-13H,1-3,10-11H2,(H,28,29)(H,24,25,27)/p-1/b18-12-