3-[5-[[3-(2-oxidanylidene-3H-1,3-benzoxazol-7-yl)piperidin-1-yl]methyl]pyridin-3-yl]benzaldehyde

Systemtic Name: 3-[5-[[3-(2-oxidanylidene-3H-1,3-benzoxazol-7-yl)piperidin-1-yl]methyl]pyridin-3-yl]benzaldehyde Openeye Name: 3-[5-[[3-(2-oxo-3H-1,3-benzoxazol-7-yl)-1-piperidyl]methyl]-3-pyridyl]benzaldehyde CAS Name: 3-[5-[[3-(2-oxo-3H-1,3-benzoxazol-7-yl)-1-piperidinyl]methyl]-3-pyridinyl]benzaldehyde IUPAC Name: 3-[5-[[3-(2-oxo-3H-1,3-benzoxazol-7-yl)piperidin-1-yl]methyl]pyridin-3-yl]benzaldehyde Traditional Name: 3-[5-[[3-(2-keto-3H-1,3-benzoxazol-7-yl)piperidino]methyl]-3-pyridyl]benzaldehyde Formula: C25H23N3O3 MolecularWeight: 413.46842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)CC2=CN=CC(=C2)C3=CC(=CC=C3)C=O)C4=C5C(=CC=C4)NC(=O)O5

Isomeric SMILES

C1CC(CN(C1)CC2=CN=CC(=C2)C3=CC(=CC=C3)C=O)C4=C5C(=CC=C4)NC(=O)O5

InChI

InChI=1S/C25H23N3O3/c29-16-17-4-1-5-19(10-17)21-11-18(12-26-13-21)14-28-9-3-6-20(15-28)22-7-2-8-23-24(22)31-25(30)27-23/h1-2,4-5,7-8,10-13,16,20H,3,6,9,14-15H2,(H,27,30)