2-[[4-(4-chlorophenyl)-2-oxidanyl-phenyl]methyl]-4-methyl-3-piperidin-1-yl-6-(propan-2-ylamino)-5-propyl-phenol

Systemtic Name: 2-[[4-(4-chlorophenyl)-2-oxidanyl-phenyl]methyl]-4-methyl-3-piperidin-1-yl-6-(propan-2-ylamino)-5-propyl-phenol Openeye Name: 2-[[4-(4-chlorophenyl)-2-hydroxy-phenyl]methyl]-6-(isopropylamino)-4-methyl-3-(1-piperidyl)-5-propyl-phenol CAS Name: 2-[[4-(4-chlorophenyl)-2-hydroxyphenyl]methyl]-4-methyl-3-(1-piperidinyl)-6-(propan-2-ylamino)-5-propylphenol IUPAC Name: 2-[[4-(4-chlorophenyl)-2-hydroxyphenyl]methyl]-4-methyl-3-piperidin-1-yl-6-(propan-2-ylamino)-5-propylphenol Traditional Name: 2-[4-(4-chlorophenyl)-2-hydroxy-benzyl]-6-(isopropylamino)-4-methyl-3-piperidino-5-propyl-phenol Formula: C31H39ClN2O2 MolecularWeight: 507.10656

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C(=C(C(=C1NC(C)C)O)CC2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)O)N4CCCCC4)C

Isomeric SMILES

CCCC1=C(C(=C(C(=C1NC(C)C)O)CC2=C(C=C(C=C2)C3=CC=C(C=C3)Cl)O)N4CCCCC4)C

InChI

InChI=1S/C31H39ClN2O2/c1-5-9-26-21(4)30(34-16-7-6-8-17-34)27(31(36)29(26)33-20(2)3)18-24-11-10-23(19-28(24)35)22-12-14-25(32)15-13-22/h10-15,19-20,33,35-36H,5-9,16-18H2,1-4H3