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

Systemtic Name: [(3S)-2-oxidanylideneazepan-3-yl]-(4-phenylcyclohexyl)azanium Openeye Name: [(3S)-2-oxoazepan-3-yl]-(4-phenylcyclohexyl)ammonium CAS Name: [(3S)-2-oxo-3-azepanyl]-(4-phenylcyclohexyl)ammonium IUPAC Name: [(3S)-2-oxoazepan-3-yl]-(4-phenylcyclohexyl)azanium Traditional Name: [(3S)-2-ketoazepan-3-yl]-(4-phenylcyclohexyl)ammonium Formula: C18H27N2O+ MolecularWeight: 287.41978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)[NH2+]C2CCC(CC2)C3=CC=CC=C3

Isomeric SMILES

C1CCNC(=O)[C@H](C1)[NH2+]C2CCC(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H26N2O/c21-18-17(8-4-5-13-19-18)20-16-11-9-15(10-12-16)14-6-2-1-3-7-14/h1-3,6-7,15-17,20H,4-5,8-13H2,(H,19,21)/p+1/t15?,16?,17-/m0/s1