[3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoyl]phenyl]methylazanium

Systemtic Name: [3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoyl]phenyl]methylazanium Openeye Name: [3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoyl]phenyl]methylammonium CAS Name: [3-[[[(1S,2R,3S)-2,3-dimethylcyclohexyl]amino]-oxomethyl]phenyl]methylammonium IUPAC Name: [3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoyl]phenyl]methylazanium Traditional Name: [3-[[(1S,2R,3S)-2,3-dimethylcyclohexyl]carbamoyl]benzyl]ammonium Formula: C16H25N2O+ MolecularWeight: 261.3825

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1C)NC(=O)C2=CC(=CC=C2)C[NH3+]

Isomeric SMILES

C[C@H]1CCC[C@@H]([C@@H]1C)NC(=O)C2=CC(=CC=C2)C[NH3+]

InChI

InChI=1S/C16H24N2O/c1-11-5-3-8-15(12(11)2)18-16(19)14-7-4-6-13(9-14)10-17/h4,6-7,9,11-12,15H,3,5,8,10,17H2,1-2H3,(H,18,19)/p+1/t11-,12+,15-/m0/s1