[2-[[3-ethoxycarbonyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: [2-[[3-ethoxycarbonyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: [2-[[3-ethoxycarbonyl-4-(4-isopropylphenyl)-2-thienyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[[3-ethoxycarbonyl-4-(4-propan-2-ylphenyl)-2-thiophenyl]amino]-2-oxoethyl]ammonium IUPAC Name: [2-[[3-ethoxycarbonyl-4-(4-propan-2-ylphenyl)thiophen-2-yl]amino]-2-oxoethyl]azanium Traditional Name: [2-[(3-carbethoxy-4-p-cumenyl-2-thienyl)amino]-2-keto-ethyl]ammonium Formula: C18H23N2O3S+ MolecularWeight: 347.45182

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)C)NC(=O)C[NH3+]

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C(C)C)NC(=O)C[NH3+]

InChI

InChI=1S/C18H22N2O3S/c1-4-23-18(22)16-14(10-24-17(16)20-15(21)9-19)13-7-5-12(6-8-13)11(2)3/h5-8,10-11H,4,9,19H2,1-3H3,(H,20,21)/p+1