(3-ethoxycarbonyl-5-oxidanyl-1-phenyl-indol-2-yl)methyl-diethyl-azanium

Systemtic Name: (3-ethoxycarbonyl-5-oxidanyl-1-phenyl-indol-2-yl)methyl-diethyl-azanium Openeye Name: (3-ethoxycarbonyl-5-hydroxy-1-phenyl-indol-2-yl)methyl-diethyl-ammonium CAS Name: (3-ethoxycarbonyl-5-hydroxy-1-phenyl-2-indolyl)methyl-diethylammonium IUPAC Name: (3-ethoxycarbonyl-5-hydroxy-1-phenylindol-2-yl)methyl-diethylazanium Traditional Name: (3-carbethoxy-5-hydroxy-1-phenyl-indol-2-yl)methyl-diethyl-ammonium Formula: C22H27N2O3+ MolecularWeight: 367.46138

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C2=C(N1C3=CC=CC=C3)C=CC(=C2)O)C(=O)OCC

Isomeric SMILES

CC[NH+](CC)CC1=C(C2=C(N1C3=CC=CC=C3)C=CC(=C2)O)C(=O)OCC

InChI

InChI=1S/C22H26N2O3/c1-4-23(5-2)15-20-21(22(26)27-6-3)18-14-17(25)12-13-19(18)24(20)16-10-8-7-9-11-16/h7-14,25H,4-6,15H2,1-3H3/p+1