[(1S,3S)-3-methylcyclohexyl]-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium

Systemtic Name: [(1S,3S)-3-methylcyclohexyl]-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]azanium Openeye Name: [(1S,3S)-3-methylcyclohexyl]-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]ammonium CAS Name: [(1S,3S)-3-methylcyclohexyl]-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]ammonium IUPAC Name: [(1S,3S)-3-methylcyclohexyl]-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]azanium Traditional Name: [4-(2-ketopyrrolidino)benzyl]-[(1S,3S)-3-methylcyclohexyl]ammonium Formula: C18H27N2O+ MolecularWeight: 287.41978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCC(C1)[NH2+]CC2=CC=C(C=C2)N3CCCC3=O

Isomeric SMILES

C[C@H]1CCC[C@@H](C1)[NH2+]CC2=CC=C(C=C2)N3CCCC3=O

InChI

InChI=1S/C18H26N2O/c1-14-4-2-5-16(12-14)19-13-15-7-9-17(10-8-15)20-11-3-6-18(20)21/h7-10,14,16,19H,2-6,11-13H2,1H3/p+1/t14-,16-/m0/s1