methyl-[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl]ammonium CAS Name: methyl-[2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl]azanium Traditional Name: benzyl-[2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl]-methyl-ammonium Formula: C18H23N4O3+ MolecularWeight: 343.40022

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O3/c1-21(13-15-5-3-2-4-6-15)14-18(23)20-12-11-19-16-7-9-17(10-8-16)22(24)25/h2-10,19H,11-14H2,1H3,(H,20,23)/p+1