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

Systemtic Name: cyclopropylmethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]azanium Openeye Name: cyclopropylmethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium CAS Name: cyclopropylmethyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]ammonium IUPAC Name: cyclopropylmethyl-[(1S)-1-(4-methyl-3-nitrophenyl)ethyl]azanium Traditional Name: cyclopropylmethyl-[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]ammonium Formula: C13H19N2O2+ MolecularWeight: 235.30216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]CC2CC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]CC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O2/c1-9-3-6-12(7-13(9)15(16)17)10(2)14-8-11-4-5-11/h3,6-7,10-11,14H,4-5,8H2,1-2H3/p+1/t10-/m0/s1