[2-[(5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(1R)-1-phenylethyl]azanium

Systemtic Name: [2-[(5-ethoxycarbonyl-4-methyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-methyl-[(1R)-1-phenylethyl]azanium Openeye Name: [2-[(5-ethoxycarbonyl-4-methyl-2-thienyl)amino]-2-oxo-ethyl]-methyl-[(1R)-1-phenylethyl]ammonium CAS Name: [2-[(5-ethoxycarbonyl-4-methyl-2-thiophenyl)amino]-2-oxoethyl]-methyl-[(1R)-1-phenylethyl]ammonium IUPAC Name: [2-[(5-ethoxycarbonyl-4-methylthiophen-2-yl)amino]-2-oxoethyl]-methyl-[(1R)-1-phenylethyl]azanium Traditional Name: [2-[(5-carbethoxy-4-methyl-2-thienyl)amino]-2-keto-ethyl]-methyl-[(1R)-1-phenylethyl]ammonium Formula: C19H25N2O3S+ MolecularWeight: 361.4784

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C=C(S1)NC(=O)C[NH+](C)C(C)C2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C1=C(C=C(S1)NC(=O)C[NH+](C)[C@H](C)C2=CC=CC=C2)C

InChI

InChI=1S/C19H24N2O3S/c1-5-24-19(23)18-13(2)11-17(25-18)20-16(22)12-21(4)14(3)15-9-7-6-8-10-15/h6-11,14H,5,12H2,1-4H3,(H,20,22)/p+1/t14-/m1/s1