ethyl-[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: ethyl-[2-[2-[(4-nitrophenyl)amino]ethylamino]-2-oxidanylidene-ethyl]-(thiophen-2-ylmethyl)azanium Openeye Name: ethyl-[2-[2-(4-nitroanilino)ethylamino]-2-oxo-ethyl]-(2-thienylmethyl)ammonium CAS Name: ethyl-[2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: ethyl-[2-[2-(4-nitroanilino)ethylamino]-2-oxoethyl]-(thiophen-2-ylmethyl)azanium Traditional Name: ethyl-[2-keto-2-[2-(4-nitroanilino)ethylamino]ethyl]-(2-thenyl)ammonium Formula: C17H23N4O3S+ MolecularWeight: 363.45452

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC1=CC=CS1)CC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC1=CC=CS1)CC(=O)NCCNC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H22N4O3S/c1-2-20(12-16-4-3-11-25-16)13-17(22)19-10-9-18-14-5-7-15(8-6-14)21(23)24/h3-8,11,18H,2,9-10,12-13H2,1H3,(H,19,22)/p+1