2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl-[(4-propan-2-ylphenyl)methyl]azanium

Systemtic Name: 2-[(2-chloranyl-4-nitro-phenyl)amino]ethyl-[(4-propan-2-ylphenyl)methyl]azanium Openeye Name: 2-(2-chloro-4-nitro-anilino)ethyl-[(4-isopropylphenyl)methyl]ammonium CAS Name: 2-(2-chloro-4-nitroanilino)ethyl-[(4-propan-2-ylphenyl)methyl]ammonium IUPAC Name: 2-(2-chloro-4-nitroanilino)ethyl-[(4-propan-2-ylphenyl)methyl]azanium Traditional Name: 2-(2-chloro-4-nitro-anilino)ethyl-(4-isopropylbenzyl)ammonium Formula: C18H23ClN3O2+ MolecularWeight: 348.84712

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22ClN3O2/c1-13(2)15-5-3-14(4-6-15)12-20-9-10-21-18-8-7-16(22(23)24)11-17(18)19/h3-8,11,13,20-21H,9-10,12H2,1-2H3/p+1