[(2S)-2-(4-chloranyl-3-nitro-phenyl)-2-(dipropylamino)ethyl]azanium

Systemtic Name: [(2S)-2-(4-chloranyl-3-nitro-phenyl)-2-(dipropylamino)ethyl]azanium Openeye Name: [(2S)-2-(4-chloro-3-nitro-phenyl)-2-(dipropylamino)ethyl]ammonium CAS Name: [(2S)-2-(4-chloro-3-nitrophenyl)-2-(dipropylamino)ethyl]ammonium IUPAC Name: [(2S)-2-(4-chloro-3-nitrophenyl)-2-(dipropylamino)ethyl]azanium Traditional Name: [(2S)-2-(4-chloro-3-nitro-phenyl)-2-(dipropylamino)ethyl]ammonium Formula: C14H23ClN3O2+ MolecularWeight: 300.80432

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)C(C[NH3+])C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCN(CCC)[C@H](C[NH3+])C1=CC(=C(C=C1)Cl)[N+](=O)[O-]

InChI

InChI=1S/C14H22ClN3O2/c1-3-7-17(8-4-2)14(10-16)11-5-6-12(15)13(9-11)18(19)20/h5-6,9,14H,3-4,7-8,10,16H2,1-2H3/p+1/t14-/m1/s1