[2-[4-[4-(diphenylmethylidene)piperidin-1-yl]-1-oxidanyl-butyl]-5-hexyl-phenyl] 2-methylpropanoate

Systemtic Name: [2-[4-[4-(diphenylmethylidene)piperidin-1-yl]-1-oxidanyl-butyl]-5-hexyl-phenyl] 2-methylpropanoate Openeye Name: [2-[4-(4-benzhydrylidene-1-piperidyl)-1-hydroxy-butyl]-5-hexyl-phenyl] 2-methylpropanoate CAS Name: 2-methylpropanoic acid [2-[4-[4-(diphenylmethylene)-1-piperidinyl]-1-hydroxybutyl]-5-hexylphenyl] ester IUPAC Name: [2-[4-(4-benzhydrylidenepiperidin-1-yl)-1-hydroxybutyl]-5-hexylphenyl] 2-methylpropanoate Traditional Name: 2-methylpropionic acid [2-[4-(4-benzhydrylidenepiperidino)-1-hydroxy-butyl]-5-hexyl-phenyl] ester Formula: C38H49NO3 MolecularWeight: 567.80056

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC(=C(C=C1)C(CCCN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2)O)OC(=O)C(C)C

Isomeric SMILES

CCCCCCC1=CC(=C(C=C1)C(CCCN2CCC(=C(C3=CC=CC=C3)C4=CC=CC=C4)CC2)O)OC(=O)C(C)C

InChI

InChI=1S/C38H49NO3/c1-4-5-6-9-15-30-21-22-34(36(28-30)42-38(41)29(2)3)35(40)20-14-25-39-26-23-33(24-27-39)37(31-16-10-7-11-17-31)32-18-12-8-13-19-32/h7-8,10-13,16-19,21-22,28-29,35,40H,4-6,9,14-15,20,23-27H2,1-3H3