4-chloranyl-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidine-5-carbaldehyde

Systemtic Name: 4-chloranyl-6-[4-(phenylmethyl)piperidin-1-yl]pyrimidine-5-carbaldehyde Openeye Name: 4-(4-benzyl-1-piperidyl)-6-chloro-pyrimidine-5-carbaldehyde CAS Name: 4-chloro-6-[4-(phenylmethyl)-1-piperidinyl]-5-pyrimidinecarboxaldehyde IUPAC Name: 4-(4-benzylpiperidin-1-yl)-6-chloropyrimidine-5-carbaldehyde Traditional Name: 4-(4-benzylpiperidino)-6-chloro-pyrimidine-5-carbaldehyde Formula: C17H18ClN3O MolecularWeight: 315.79732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)Cl)C=O

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C3=C(C(=NC=N3)Cl)C=O

InChI

InChI=1S/C17H18ClN3O/c18-16-15(11-22)17(20-12-19-16)21-8-6-14(7-9-21)10-13-4-2-1-3-5-13/h1-5,11-12,14H,6-10H2