[2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium

Systemtic Name: [2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(propylamino)ethyl]azanium Openeye Name: [2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-[2-oxo-2-(propylamino)ethyl]ammonium CAS Name: [2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methyl-2-thiophenyl)amino]-2-oxoethyl]-methyl-[2-oxo-2-(propylamino)ethyl]ammonium IUPAC Name: [2-[(3-ethoxycarbonyl-5-methoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl]-methyl-[2-oxo-2-(propylamino)ethyl]azanium Traditional Name: [2-[(3-carbethoxy-5-carbomethoxy-4-methyl-2-thienyl)amino]-2-keto-ethyl]-[2-keto-2-(propylamino)ethyl]-methyl-ammonium Formula: C18H28N3O6S+ MolecularWeight: 414.49642

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+](C)CC(=O)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OCC

Isomeric SMILES

CCCNC(=O)C[NH+](C)CC(=O)NC1=C(C(=C(S1)C(=O)OC)C)C(=O)OCC

InChI

InChI=1S/C18H27N3O6S/c1-6-8-19-12(22)9-21(4)10-13(23)20-16-14(17(24)27-7-2)11(3)15(28-16)18(25)26-5/h6-10H2,1-5H3,(H,19,22)(H,20,23)/p+1