4-[[3-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one

Systemtic Name: 4-[[3-[4-(phenylmethyl)piperidin-1-yl]carbonylphenyl]methyl]-1,4-benzoxazin-3-one Openeye Name: 4-[[3-(4-benzylpiperidine-1-carbonyl)phenyl]methyl]-1,4-benzoxazin-3-one CAS Name: 4-[[3-[oxo-[4-(phenylmethyl)-1-piperidinyl]methyl]phenyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 4-[[3-(4-benzylpiperidine-1-carbonyl)phenyl]methyl]-1,4-benzoxazin-3-one Traditional Name: 4-[3-(4-benzylpiperidine-1-carbonyl)benzyl]-1,4-benzoxazin-3-one Formula: C28H28N2O3 MolecularWeight: 440.53352

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)CN4C(=O)COC5=CC=CC=C54

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=CC(=CC=C3)CN4C(=O)COC5=CC=CC=C54

InChI

InChI=1S/C28H28N2O3/c31-27-20-33-26-12-5-4-11-25(26)30(27)19-23-9-6-10-24(18-23)28(32)29-15-13-22(14-16-29)17-21-7-2-1-3-8-21/h1-12,18,22H,13-17,19-20H2