7-chloranyl-2-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1H-quinazolin-4-one

Systemtic Name: 7-chloranyl-2-[[4-(phenylmethyl)piperidin-1-yl]methyl]-1H-quinazolin-4-one Openeye Name: 2-[(4-benzyl-1-piperidyl)methyl]-7-chloro-1H-quinazolin-4-one CAS Name: 7-chloro-2-[[4-(phenylmethyl)-1-piperidinyl]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(4-benzylpiperidin-1-yl)methyl]-7-chloro-1H-quinazolin-4-one Traditional Name: 2-[(4-benzylpiperidino)methyl]-7-chloro-1H-quinazolin-4-one Formula: C21H22ClN3O MolecularWeight: 367.87188

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)CC3=NC(=O)C4=C(N3)C=C(C=C4)Cl

InChI

InChI=1S/C21H22ClN3O/c22-17-6-7-18-19(13-17)23-20(24-21(18)26)14-25-10-8-16(9-11-25)12-15-4-2-1-3-5-15/h1-7,13,16H,8-12,14H2,(H,23,24,26)