[2-[[5-(3-cyclohexylpropanoylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[5-(3-cyclohexylpropanoylamino)-2-methyl-phenyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[5-(3-cyclohexylpropanoylamino)-2-methyl-anilino]-2-oxo-ethyl]ammonium CAS Name: [2-[5-[(3-cyclohexyl-1-oxopropyl)amino]-2-methylanilino]-2-oxoethyl]ammonium IUPAC Name: [2-[5-(3-cyclohexylpropanoylamino)-2-methylanilino]-2-oxoethyl]azanium Traditional Name: [2-[5-(3-cyclohexylpropanoylamino)-2-methyl-anilino]-2-keto-ethyl]ammonium Formula: C18H28N3O2+ MolecularWeight: 318.43382

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2CCCCC2)NC(=O)C[NH3+]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2CCCCC2)NC(=O)C[NH3+]

InChI

InChI=1S/C18H27N3O2/c1-13-7-9-15(11-16(13)21-18(23)12-19)20-17(22)10-8-14-5-3-2-4-6-14/h7,9,11,14H,2-6,8,10,12,19H2,1H3,(H,20,22)(H,21,23)/p+1