[(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-(2-pyrrolidin-1-ylethyl)azanium

Systemtic Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-(2-pyrrolidin-1-ylethyl)azanium Openeye Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-(2-pyrrolidin-1-ylethyl)ammonium CAS Name: [(1S)-1-(4-methyl-3-nitrophenyl)ethyl]-[2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: [(1S)-1-(4-methyl-3-nitrophenyl)ethyl]-(2-pyrrolidin-1-ylethyl)azanium Traditional Name: [(1S)-1-(4-methyl-3-nitro-phenyl)ethyl]-(2-pyrrolidinoethyl)ammonium Formula: C15H24N3O2+ MolecularWeight: 278.36996

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(C)[NH2+]CCN2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)[C@H](C)[NH2+]CCN2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C15H23N3O2/c1-12-5-6-14(11-15(12)18(19)20)13(2)16-7-10-17-8-3-4-9-17/h5-6,11,13,16H,3-4,7-10H2,1-2H3/p+1/t13-/m0/s1