[4-[[4-(cyclohexylcarbonylamino)-3-methyl-phenyl]amino]-4-oxidanylidene-butyl]azanium

Systemtic Name: [4-[[4-(cyclohexylcarbonylamino)-3-methyl-phenyl]amino]-4-oxidanylidene-butyl]azanium Openeye Name: [4-[4-(cyclohexanecarbonylamino)-3-methyl-anilino]-4-oxo-butyl]ammonium CAS Name: [4-[4-[[cyclohexyl(oxo)methyl]amino]-3-methylanilino]-4-oxobutyl]ammonium IUPAC Name: [4-[4-(cyclohexanecarbonylamino)-3-methylanilino]-4-oxobutyl]azanium Traditional Name: [4-[4-(cyclohexanecarbonylamino)-3-methyl-anilino]-4-keto-butyl]ammonium Formula: C18H28N3O2+ MolecularWeight: 318.43382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC[NH3+])NC(=O)C2CCCCC2

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC[NH3+])NC(=O)C2CCCCC2

InChI

InChI=1S/C18H27N3O2/c1-13-12-15(20-17(22)8-5-11-19)9-10-16(13)21-18(23)14-6-3-2-4-7-14/h9-10,12,14H,2-8,11,19H2,1H3,(H,20,22)(H,21,23)/p+1