1-[[1-(phenylmethyl)piperidin-4-yl]methyl]-3-(3,4,5-trimethoxyphenyl)urea

Systemtic Name: 1-[[1-(phenylmethyl)piperidin-4-yl]methyl]-3-(3,4,5-trimethoxyphenyl)urea Openeye Name: 1-[(1-benzyl-4-piperidyl)methyl]-3-(3,4,5-trimethoxyphenyl)urea CAS Name: 1-[[1-(phenylmethyl)-4-piperidinyl]methyl]-3-(3,4,5-trimethoxyphenyl)urea IUPAC Name: 1-[(1-benzylpiperidin-4-yl)methyl]-3-(3,4,5-trimethoxyphenyl)urea Traditional Name: 1-[(1-benzyl-4-piperidyl)methyl]-3-(3,4,5-trimethoxyphenyl)urea Formula: C23H31N3O4 MolecularWeight: 413.50994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=O)NCC2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=O)NCC2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C23H31N3O4/c1-28-20-13-19(14-21(29-2)22(20)30-3)25-23(27)24-15-17-9-11-26(12-10-17)16-18-7-5-4-6-8-18/h4-8,13-14,17H,9-12,15-16H2,1-3H3,(H2,24,25,27)