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

Systemtic Name: cyclohexyl-[2-[(3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxidanylidene-ethyl]-ethyl-azanium Openeye Name: cyclohexyl-[2-[(3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-oxo-ethyl]-ethyl-ammonium CAS Name: cyclohexyl-[2-[(3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-ethylammonium IUPAC Name: cyclohexyl-[2-[(3-ethoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)amino]-2-oxoethyl]-ethylazanium Traditional Name: [2-[(3-carbethoxy-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl)amino]-2-keto-ethyl]-cyclohexyl-ethyl-ammonium Formula: C22H35N2O3S+ MolecularWeight: 407.5899

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)OCC)C3CCCCC3

Isomeric SMILES

CC[NH+](CC(=O)NC1=C(C2=C(S1)CC(CC2)C)C(=O)OCC)C3CCCCC3

InChI

InChI=1S/C22H34N2O3S/c1-4-24(16-9-7-6-8-10-16)14-19(25)23-21-20(22(26)27-5-2)17-12-11-15(3)13-18(17)28-21/h15-16H,4-14H2,1-3H3,(H,23,25)/p+1