(5-chloranyl-2-methoxy-phenyl)methyl-[2-[(4-nitrophenyl)amino]ethyl]azanium

Systemtic Name: (5-chloranyl-2-methoxy-phenyl)methyl-[2-[(4-nitrophenyl)amino]ethyl]azanium Openeye Name: (5-chloro-2-methoxy-phenyl)methyl-[2-(4-nitroanilino)ethyl]ammonium CAS Name: (5-chloro-2-methoxyphenyl)methyl-[2-(4-nitroanilino)ethyl]ammonium IUPAC Name: (5-chloro-2-methoxyphenyl)methyl-[2-(4-nitroanilino)ethyl]azanium Traditional Name: (5-chloro-2-methoxy-benzyl)-[2-(4-nitroanilino)ethyl]ammonium Formula: C16H19ClN3O3+ MolecularWeight: 336.79336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)C[NH2+]CCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)C[NH2+]CCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H18ClN3O3/c1-23-16-7-2-13(17)10-12(16)11-18-8-9-19-14-3-5-15(6-4-14)20(21)22/h2-7,10,18-19H,8-9,11H2,1H3/p+1