[2-[(2-imidazol-1-ylphenyl)methyl]-6,7-dihydro-1-benzothiophen-5-yl] hydrogen carbonate

Systemtic Name: [2-[(2-imidazol-1-ylphenyl)methyl]-6,7-dihydro-1-benzothiophen-5-yl] hydrogen carbonate Openeye Name: [2-[(2-imidazol-1-ylphenyl)methyl]-6,7-dihydrobenzothiophen-5-yl] hydrogen carbonate CAS Name: carbonic acid [2-[[2-(1-imidazolyl)phenyl]methyl]-6,7-dihydro-1-benzothiophen-5-yl] ester IUPAC Name: [2-[(2-imidazol-1-ylphenyl)methyl]-6,7-dihydro-1-benzothiophen-5-yl] hydrogen carbonate Traditional Name: carbonic acid [2-(2-imidazol-1-ylbenzyl)-6,7-dihydrobenzothiophen-5-yl] ester Formula: C19H16N2O3S MolecularWeight: 352.40694

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C=C1OC(=O)O)C=C(S2)CC3=CC=CC=C3N4C=CN=C4

Isomeric SMILES

C1CC2=C(C=C1OC(=O)O)C=C(S2)CC3=CC=CC=C3N4C=CN=C4

InChI

InChI=1S/C19H16N2O3S/c22-19(23)24-15-5-6-18-14(9-15)11-16(25-18)10-13-3-1-2-4-17(13)21-8-7-20-12-21/h1-4,7-9,11-12H,5-6,10H2,(H,22,23)