1-[3-ethenyl-1-heptyl-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidin-3-yl]urea

Systemtic Name: 1-[3-ethenyl-1-heptyl-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidin-3-yl]urea Openeye Name: [1-heptyl-4-[3-(6-methoxy-4-quinolyl)propyl]-3-vinyl-3-piperidyl]urea CAS Name: [3-ethenyl-1-heptyl-4-[3-(6-methoxy-4-quinolinyl)propyl]-3-piperidinyl]urea IUPAC Name: [3-ethenyl-1-heptyl-4-[3-(6-methoxyquinolin-4-yl)propyl]piperidin-3-yl]urea Traditional Name: [1-heptyl-4-[3-(6-methoxy-4-quinolyl)propyl]-3-vinyl-3-piperidyl]urea Formula: C28H42N4O2 MolecularWeight: 466.65868

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1CCC(C(C1)(C=C)NC(=O)N)CCCC2=C3C=C(C=CC3=NC=C2)OC

Isomeric SMILES

CCCCCCCN1CCC(C(C1)(C=C)NC(=O)N)CCCC2=C3C=C(C=CC3=NC=C2)OC

InChI

InChI=1S/C28H42N4O2/c1-4-6-7-8-9-18-32-19-16-23(28(5-2,21-32)31-27(29)33)12-10-11-22-15-17-30-26-14-13-24(34-3)20-25(22)26/h5,13-15,17,20,23H,2,4,6-12,16,18-19,21H2,1,3H3,(H3,29,31,33)