6,7-dimethoxy-3-[3-[1-(phenylmethyl)piperidin-4-yl]propyl]-1,2-benzoxazole

Systemtic Name: 6,7-dimethoxy-3-[3-[1-(phenylmethyl)piperidin-4-yl]propyl]-1,2-benzoxazole Openeye Name: 3-[3-(1-benzyl-4-piperidyl)propyl]-6,7-dimethoxy-1,2-benzoxazole CAS Name: 6,7-dimethoxy-3-[3-[1-(phenylmethyl)-4-piperidinyl]propyl]-1,2-benzoxazole IUPAC Name: 3-[3-(1-benzylpiperidin-4-yl)propyl]-6,7-dimethoxy-1,2-benzoxazole Traditional Name: 3-[3-(1-benzyl-4-piperidyl)propyl]-6,7-dimethoxy-indoxazene Formula: C24H30N2O3 MolecularWeight: 394.5066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(=NO2)CCCC3CCN(CC3)CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(=NO2)CCCC3CCN(CC3)CC4=CC=CC=C4)OC

InChI

InChI=1S/C24H30N2O3/c1-27-22-12-11-20-21(25-29-23(20)24(22)28-2)10-6-9-18-13-15-26(16-14-18)17-19-7-4-3-5-8-19/h3-5,7-8,11-12,18H,6,9-10,13-17H2,1-2H3