(1-cyclohexyl-3-ethoxycarbonyl-2-methyl-5-oxidanyl-indol-4-yl)methyl-dimethyl-azanium

Systemtic Name: (1-cyclohexyl-3-ethoxycarbonyl-2-methyl-5-oxidanyl-indol-4-yl)methyl-dimethyl-azanium Openeye Name: (1-cyclohexyl-3-ethoxycarbonyl-5-hydroxy-2-methyl-indol-4-yl)methyl-dimethyl-ammonium CAS Name: (1-cyclohexyl-3-ethoxycarbonyl-5-hydroxy-2-methyl-4-indolyl)methyl-dimethylammonium IUPAC Name: (1-cyclohexyl-3-ethoxycarbonyl-5-hydroxy-2-methylindol-4-yl)methyl-dimethylazanium Traditional Name: (3-carbethoxy-1-cyclohexyl-5-hydroxy-2-methyl-indol-4-yl)methyl-dimethyl-ammonium Formula: C21H31N2O3+ MolecularWeight: 359.48244

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)C[NH+](C)C)C3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C(=C(C=C2)O)C[NH+](C)C)C3CCCCC3)C

InChI

InChI=1S/C21H30N2O3/c1-5-26-21(25)19-14(2)23(15-9-7-6-8-10-15)17-11-12-18(24)16(20(17)19)13-22(3)4/h11-12,15,24H,5-10,13H2,1-4H3/p+1