methyl 2-[(3-methoxy-2-oxidanyl-phenyl)iminomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate

Systemtic Name: methyl 2-[(3-methoxy-2-oxidanyl-phenyl)iminomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Openeye Name: methyl 2-[(2-hydroxy-3-methoxy-phenyl)iminomethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylate CAS Name: 2-[(2-hydroxy-3-methoxyphenyl)iminomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylic acid methyl ester IUPAC Name: methyl 2-[(2-hydroxy-3-methoxyphenyl)iminomethyl]-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxylate Traditional Name: 2-[(2-hydroxy-3-methoxy-phenyl)iminomethyl]-4,5,6,7-tetrahydrobenzothiophene-3-carboxylic acid methyl ester Formula: C18H19NO4S MolecularWeight: 345.41276

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1O)N=CC2=C(C3=C(S2)CCCC3)C(=O)OC

Isomeric SMILES

COC1=CC=CC(=C1O)N=CC2=C(C3=C(S2)CCCC3)C(=O)OC

InChI

InChI=1S/C18H19NO4S/c1-22-13-8-5-7-12(17(13)20)19-10-15-16(18(21)23-2)11-6-3-4-9-14(11)24-15/h5,7-8,10,20H,3-4,6,9H2,1-2H3