cyclohexyl-(2-ethoxy-2-oxidanylidene-ethyl)-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]azanium

Systemtic Name: cyclohexyl-(2-ethoxy-2-oxidanylidene-ethyl)-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]azanium Openeye Name: cyclohexyl-(2-ethoxy-2-oxo-ethyl)-[[1-(m-tolylmethyl)pyrrol-2-yl]methyl]ammonium CAS Name: cyclohexyl-(2-ethoxy-2-oxoethyl)-[[1-[(3-methylphenyl)methyl]-2-pyrrolyl]methyl]ammonium IUPAC Name: cyclohexyl-(2-ethoxy-2-oxoethyl)-[[1-[(3-methylphenyl)methyl]pyrrol-2-yl]methyl]azanium Traditional Name: cyclohexyl-(2-ethoxy-2-keto-ethyl)-[[1-(3-methylbenzyl)pyrrol-2-yl]methyl]ammonium Formula: C23H33N2O2+ MolecularWeight: 369.52032

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C[NH+](CC1=CC=CN1CC2=CC=CC(=C2)C)C3CCCCC3

Isomeric SMILES

CCOC(=O)C[NH+](CC1=CC=CN1CC2=CC=CC(=C2)C)C3CCCCC3

InChI

InChI=1S/C23H32N2O2/c1-3-27-23(26)18-25(21-11-5-4-6-12-21)17-22-13-8-14-24(22)16-20-10-7-9-19(2)15-20/h7-10,13-15,21H,3-6,11-12,16-18H2,1-2H3/p+1