(4-methylcyclohexyl)-[(3S)-2-oxidanylideneazepan-3-yl]azanium

Systemtic Name: (4-methylcyclohexyl)-[(3S)-2-oxidanylideneazepan-3-yl]azanium Openeye Name: (4-methylcyclohexyl)-[(3S)-2-oxoazepan-3-yl]ammonium CAS Name: (4-methylcyclohexyl)-[(3S)-2-oxo-3-azepanyl]ammonium IUPAC Name: (4-methylcyclohexyl)-[(3S)-2-oxoazepan-3-yl]azanium Traditional Name: [(3S)-2-ketoazepan-3-yl]-(4-methylcyclohexyl)ammonium Formula: C13H25N2O+ MolecularWeight: 225.3504

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(CC1)[NH2+]C2CCCCNC2=O

Isomeric SMILES

CC1CCC(CC1)[NH2+][C@H]2CCCCNC2=O

InChI

InChI=1S/C13H24N2O/c1-10-5-7-11(8-6-10)15-12-4-2-3-9-14-13(12)16/h10-12,15H,2-9H2,1H3,(H,14,16)/p+1/t10?,11?,12-/m0/s1