[2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-2-ylmethyl)azanium

Systemtic Name: [2-[(5-methoxycarbonyl-2-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-2-ylmethyl)azanium Openeye Name: [2-(5-methoxycarbonyl-2-methyl-anilino)-2-oxo-ethyl]-methyl-(2-thienylmethyl)ammonium CAS Name: [2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-methyl-(thiophen-2-ylmethyl)ammonium IUPAC Name: [2-(5-methoxycarbonyl-2-methylanilino)-2-oxoethyl]-methyl-(thiophen-2-ylmethyl)azanium Traditional Name: [2-(5-carbomethoxy-2-methyl-anilino)-2-keto-ethyl]-methyl-(2-thenyl)ammonium Formula: C17H21N2O3S+ MolecularWeight: 333.42524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C[NH+](C)CC2=CC=CS2

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)OC)NC(=O)C[NH+](C)CC2=CC=CS2

InChI

InChI=1S/C17H20N2O3S/c1-12-6-7-13(17(21)22-3)9-15(12)18-16(20)11-19(2)10-14-5-4-8-23-14/h4-9H,10-11H2,1-3H3,(H,18,20)/p+1