methyl 1-azanyl-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxylate

Systemtic Name: methyl 1-azanyl-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxylate Openeye Name: methyl 1-amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxylate CAS Name: 1-amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxylic acid methyl ester IUPAC Name: methyl 1-amino-5-methyl-6,7,8,9-tetrahydrothieno[2,3-c]isoquinolin-4-ium-2-carboxylate Traditional Name: 1-amino-5-methyl-6,7,8,9-tetrahydrothien[2,3-c]isoquinolin-4-ium-2-carboxylic acid methyl ester Formula: C14H17N2O2S+ MolecularWeight: 277.36198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2CCCCC2=C3C(=C(SC3=[NH+]1)C(=O)OC)N

Isomeric SMILES

CC1=C2CCCCC2=C3C(=C(SC3=[NH+]1)C(=O)OC)N

InChI

InChI=1S/C14H16N2O2S/c1-7-8-5-3-4-6-9(8)10-11(15)12(14(17)18-2)19-13(10)16-7/h3-6,15H2,1-2H3/p+1