3-[3-[1-(cyclohexylmethyl)piperidin-4-yl]propyl]-6-phenylmethoxy-1,2-benzoxazole

Systemtic Name: 3-[3-[1-(cyclohexylmethyl)piperidin-4-yl]propyl]-6-phenylmethoxy-1,2-benzoxazole Openeye Name: 6-benzyloxy-3-[3-[1-(cyclohexylmethyl)-4-piperidyl]propyl]-1,2-benzoxazole CAS Name: 3-[3-[1-(cyclohexylmethyl)-4-piperidinyl]propyl]-6-phenylmethoxy-1,2-benzoxazole IUPAC Name: 3-[3-[1-(cyclohexylmethyl)piperidin-4-yl]propyl]-6-phenylmethoxy-1,2-benzoxazole Traditional Name: 6-benzoxy-3-[3-[1-(cyclohexylmethyl)-4-piperidyl]propyl]indoxazene Formula: C29H38N2O2 MolecularWeight: 446.62422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)CN2CCC(CC2)CCCC3=NOC4=C3C=CC(=C4)OCC5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)CN2CCC(CC2)CCCC3=NOC4=C3C=CC(=C4)OCC5=CC=CC=C5

InChI

InChI=1S/C29H38N2O2/c1-3-8-24(9-4-1)21-31-18-16-23(17-19-31)12-7-13-28-27-15-14-26(20-29(27)33-30-28)32-22-25-10-5-2-6-11-25/h2,5-6,10-11,14-15,20,23-24H,1,3-4,7-9,12-13,16-19,21-22H2