[2-[[3-ethoxycarbonyl-5-(2-methoxyethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-(phenylmethyl)-propan-2-yl-azanium

Systemtic Name: [2-[[3-ethoxycarbonyl-5-(2-methoxyethoxycarbonyl)-4-methyl-thiophen-2-yl]amino]-2-oxidanylidene-ethyl]-(phenylmethyl)-propan-2-yl-azanium Openeye Name: benzyl-[2-[[3-ethoxycarbonyl-5-(2-methoxyethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-oxo-ethyl]-isopropyl-ammonium CAS Name: [2-[[3-ethoxycarbonyl-5-[2-methoxyethoxy(oxo)methyl]-4-methyl-2-thiophenyl]amino]-2-oxoethyl]-(phenylmethyl)-propan-2-ylammonium IUPAC Name: benzyl-[2-[[3-ethoxycarbonyl-5-(2-methoxyethoxycarbonyl)-4-methylthiophen-2-yl]amino]-2-oxoethyl]-propan-2-ylazanium Traditional Name: benzyl-[2-[[3-carbethoxy-5-(2-methoxyethoxycarbonyl)-4-methyl-2-thienyl]amino]-2-keto-ethyl]-isopropyl-ammonium Formula: C24H33N2O6S+ MolecularWeight: 477.59362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCCOC)NC(=O)C[NH+](CC2=CC=CC=C2)C(C)C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCCOC)NC(=O)C[NH+](CC2=CC=CC=C2)C(C)C

InChI

InChI=1S/C24H32N2O6S/c1-6-31-23(28)20-17(4)21(24(29)32-13-12-30-5)33-22(20)25-19(27)15-26(16(2)3)14-18-10-8-7-9-11-18/h7-11,16H,6,12-15H2,1-5H3,(H,25,27)/p+1