cyclohexyl-[2-[[3-ethoxycarbonyl-4-(4-methylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: cyclohexyl-[2-[[3-ethoxycarbonyl-4-(4-methylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: cyclohexyl-[2-[[3-ethoxycarbonyl-4-(p-tolyl)-2-thienyl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: cyclohexyl-[2-[[3-ethoxycarbonyl-4-(4-methylphenyl)-2-thiophenyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: cyclohexyl-[2-[[3-ethoxycarbonyl-4-(4-methylphenyl)thiophen-2-yl]amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[[3-carbethoxy-4-(p-tolyl)-2-thienyl]amino]-2-keto-ethyl]-cyclohexyl-methyl-ammonium Formula: C23H31N2O3S+ MolecularWeight: 415.56884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C[NH+](C)C3CCCCC3

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)C[NH+](C)C3CCCCC3

InChI

InChI=1S/C23H30N2O3S/c1-4-28-23(27)21-19(17-12-10-16(2)11-13-17)15-29-22(21)24-20(26)14-25(3)18-8-6-5-7-9-18/h10-13,15,18H,4-9,14H2,1-3H3,(H,24,26)/p+1