cyclohexyl-[2-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium

Systemtic Name: cyclohexyl-[2-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: cyclohexyl-[2-[(3-ethoxycarbonyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]-ethyl-ammonium CAS Name: cyclohexyl-[2-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-ethylammonium IUPAC Name: cyclohexyl-[2-[(3-ethoxycarbonyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-ethylazanium Traditional Name: [2-[(3-carbethoxy-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]-cyclohexyl-ethyl-ammonium Formula: C21H33N2O3S+ MolecularWeight: 393.56332

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OCC)C3CCCCC3

Isomeric SMILES

CC[NH+](CC(=O)NC1=C(C2=C(S1)CCCC2)C(=O)OCC)C3CCCCC3

InChI

InChI=1S/C21H32N2O3S/c1-3-23(15-10-6-5-7-11-15)14-18(24)22-20-19(21(25)26-4-2)16-12-8-9-13-17(16)27-20/h15H,3-14H2,1-2H3,(H,22,24)/p+1