cyclohexyl-[(2S)-3-methyl-1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl]azanium

Systemtic Name: cyclohexyl-[(2S)-3-methyl-1-[(2-methylphenyl)amino]-1-oxidanylidene-butan-2-yl]azanium Openeye Name: cyclohexyl-[(1S)-2-methyl-1-(o-tolylcarbamoyl)propyl]ammonium CAS Name: cyclohexyl-[(2S)-3-methyl-1-(2-methylanilino)-1-oxobutan-2-yl]ammonium IUPAC Name: cyclohexyl-[(2S)-3-methyl-1-(2-methylanilino)-1-oxobutan-2-yl]azanium Traditional Name: cyclohexyl-[(1S)-2-methyl-1-(o-tolylcarbamoyl)propyl]ammonium Formula: C18H29N2O+ MolecularWeight: 289.43566

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)C(C(C)C)[NH2+]C2CCCCC2

Isomeric SMILES

CC1=CC=CC=C1NC(=O)[C@H](C(C)C)[NH2+]C2CCCCC2

InChI

InChI=1S/C18H28N2O/c1-13(2)17(19-15-10-5-4-6-11-15)18(21)20-16-12-8-7-9-14(16)3/h7-9,12-13,15,17,19H,4-6,10-11H2,1-3H3,(H,20,21)/p+1/t17-/m0/s1