[2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [2-[(2-ethyl-6-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [2-(2-ethyl-6-methyl-anilino)-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [2-(2-ethyl-6-methylanilino)-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [2-(2-ethyl-6-methyl-anilino)-2-keto-ethyl]-(4-isopropylbenzyl)-methyl-ammonium Formula: C22H31N2O+ MolecularWeight: 339.49434

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C)C

InChI

InChI=1S/C22H30N2O/c1-6-19-9-7-8-17(4)22(19)23-21(25)15-24(5)14-18-10-12-20(13-11-18)16(2)3/h7-13,16H,6,14-15H2,1-5H3,(H,23,25)/p+1