[2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: [2-[(2-chloranyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: [2-(2-chloro-4-nitro-anilino)-2-oxo-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl]-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: [2-(2-chloro-4-nitroanilino)-2-oxoethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [2-(2-chloro-4-nitro-anilino)-2-keto-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C15H17ClN3O3S+ MolecularWeight: 354.83178

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](C)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

Isomeric SMILES

CC1=C(SC=C1)C[NH+](C)CC(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])Cl

InChI

InChI=1S/C15H16ClN3O3S/c1-10-5-6-23-14(10)8-18(2)9-15(20)17-13-4-3-11(19(21)22)7-12(13)16/h3-7H,8-9H2,1-2H3,(H,17,20)/p+1