(2R)-1-(azepan-1-ium-1-yl)-3-(5-methyl-2,3-diphenyl-indol-1-yl)propan-2-ol

Systemtic Name: (2R)-1-(azepan-1-ium-1-yl)-3-(5-methyl-2,3-diphenyl-indol-1-yl)propan-2-ol Openeye Name: (2R)-1-(azepan-1-ium-1-yl)-3-(5-methyl-2,3-diphenyl-indol-1-yl)propan-2-ol CAS Name: (2R)-1-(1-azepan-1-iumyl)-3-(5-methyl-2,3-diphenyl-1-indolyl)-2-propanol IUPAC Name: (2R)-1-(azepan-1-ium-1-yl)-3-(5-methyl-2,3-diphenylindol-1-yl)propan-2-ol Traditional Name: (2R)-1-(azepan-1-ium-1-yl)-3-(5-methyl-2,3-diphenyl-indol-1-yl)propan-2-ol Formula: C30H35N2O+ MolecularWeight: 439.6117

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)CC(C[NH+]5CCCCCC5)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C3=CC=CC=C3)C4=CC=CC=C4)C[C@H](C[NH+]5CCCCCC5)O

InChI

InChI=1S/C30H34N2O/c1-23-16-17-28-27(20-23)29(24-12-6-4-7-13-24)30(25-14-8-5-9-15-25)32(28)22-26(33)21-31-18-10-2-3-11-19-31/h4-9,12-17,20,26,33H,2-3,10-11,18-19,21-22H2,1H3/p+1/t26-/m0/s1