furan-2-ylmethyl-[2-[[(6S)-3-methoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: furan-2-ylmethyl-[2-[[(6S)-3-methoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: 2-furylmethyl-[2-[[(6S)-3-methoxycarbonyl-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-oxo-ethyl]-methyl-ammonium CAS Name: 2-furanylmethyl-[2-[[(6S)-3-methoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl]-methylammonium IUPAC Name: furan-2-ylmethyl-[2-[[(6S)-3-methoxycarbonyl-6-methyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]amino]-2-oxoethyl]-methylazanium Traditional Name: [2-[[(6S)-3-carbomethoxy-6-methyl-4,5,6,7-tetrahydrobenzothiophen-2-yl]amino]-2-keto-ethyl]-(2-furfuryl)-methyl-ammonium Formula: C19H25N2O4S+ MolecularWeight: 377.4778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C[NH+](C)CC3=CC=CO3

Isomeric SMILES

C[C@H]1CCC2=C(C1)SC(=C2C(=O)OC)NC(=O)C[NH+](C)CC3=CC=CO3

InChI

InChI=1S/C19H24N2O4S/c1-12-6-7-14-15(9-12)26-18(17(14)19(23)24-3)20-16(22)11-21(2)10-13-5-4-8-25-13/h4-5,8,12H,6-7,9-11H2,1-3H3,(H,20,22)/p+1/t12-/m0/s1