1-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indol-1-ium-5-ol

Systemtic Name: 1-(3-methoxy-4-oxidanyl-phenyl)-3-methyl-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indol-1-ium-5-ol Openeye Name: 1-(4-hydroxy-3-methoxy-phenyl)-3-methyl-1-[[4-[2-(1-piperidyl)ethoxy]phenyl]methyl]indol-1-ium-5-ol CAS Name: 1-(4-hydroxy-3-methoxyphenyl)-3-methyl-1-[[4-[2-(1-piperidinyl)ethoxy]phenyl]methyl]-5-indol-1-iumol IUPAC Name: 1-(4-hydroxy-3-methoxyphenyl)-3-methyl-1-[[4-(2-piperidin-1-ylethoxy)phenyl]methyl]indol-1-ium-5-ol Traditional Name: 1-(4-hydroxy-3-methoxy-phenyl)-3-methyl-1-[4-(2-piperidinoethoxy)benzyl]indol-1-ium-5-ol Formula: C30H35N2O4+ MolecularWeight: 487.6099

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](C2=C1C=C(C=C2)O)(CC3=CC=C(C=C3)OCCN4CCCCC4)C5=CC(=C(C=C5)O)OC

Isomeric SMILES

CC1=C[N+](C2=C1C=C(C=C2)O)(CC3=CC=C(C=C3)OCCN4CCCCC4)C5=CC(=C(C=C5)O)OC

InChI

InChI=1S/C30H34N2O4/c1-22-20-32(28-12-9-25(33)19-27(22)28,24-8-13-29(34)30(18-24)35-2)21-23-6-10-26(11-7-23)36-17-16-31-14-4-3-5-15-31/h6-13,18-20H,3-5,14-17,21H2,1-2H3,(H-,33,34)/p+1