[2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: [2-[(2,5-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: [2-(2,5-dimethylanilino)-2-oxo-ethyl]-[(4-isopropylphenyl)methyl]-methyl-ammonium CAS Name: [2-(2,5-dimethylanilino)-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: [2-(2,5-dimethylanilino)-2-oxoethyl]-methyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: [2-(2,5-dimethylanilino)-2-keto-ethyl]-(4-isopropylbenzyl)-methyl-ammonium Formula: C21H29N2O+ MolecularWeight: 325.46776

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C[NH+](C)CC2=CC=C(C=C2)C(C)C

InChI

InChI=1S/C21H28N2O/c1-15(2)19-10-8-18(9-11-19)13-23(5)14-21(24)22-20-12-16(3)6-7-17(20)4/h6-12,15H,13-14H2,1-5H3,(H,22,24)/p+1