cycloheptyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium

Systemtic Name: cycloheptyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium Openeye Name: cycloheptyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: cycloheptyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: cycloheptyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: cycloheptyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C16H25N2O2+ MolecularWeight: 277.3819

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]C2CCCCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]C2CCCCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H24N2O2/c1-12-9-10-14(11-16(12)18(19)20)13(2)17-15-7-5-3-4-6-8-15/h9-11,13,15,17H,3-8H2,1-2H3/p+1/t13-/m0/s1