2-(4-hydroxyphenyl)-5-oxidanyl-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indole-3-carbonitrile hydrochloride

Systemtic Name: 2-(4-hydroxyphenyl)-5-oxidanyl-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indole-3-carbonitrile hydrochloride Openeye Name: 5-hydroxy-2-(4-hydroxyphenyl)-1-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]indole-3-carbonitrile hydrochloride CAS Name: 5-hydroxy-2-(4-hydroxyphenyl)-1-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-3-indolecarbonitrile hydrochloride IUPAC Name: 5-hydroxy-2-(4-hydroxyphenyl)-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indole-3-carbonitrile hydrochloride Traditional Name: 5-hydroxy-2-(4-hydroxyphenyl)-1-[4-(2-piperidinoethoxy)benzyl]indole-3-carbonitrile hydrochloride Formula: C29H30ClN3O3 MolecularWeight: 504.0198

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CCOC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)O)C(=C3C5=CC=C(C=C5)O)C#N.Cl

Isomeric SMILES

C1CCN(CC1)CCOC2=CC=C(C=C2)CN3C4=C(C=C(C=C4)O)C(=C3C5=CC=C(C=C5)O)C#N.Cl

InChI

InChI=1S/C29H29N3O3.ClH/c30-19-27-26-18-24(34)10-13-28(26)32(29(27)22-6-8-23(33)9-7-22)20-21-4-11-25(12-5-21)35-17-16-31-14-2-1-3-15-31;/h4-13,18,33-34H,1-3,14-17,20H2;1H