2-(imidazol-1-ylmethyl)-2H-chromene-6-carboxylate hydrochloride

Systemtic Name: 2-(imidazol-1-ylmethyl)-2H-chromene-6-carboxylate hydrochloride Openeye Name: 2-(imidazol-1-ylmethyl)-2H-chromene-6-carboxylate hydrochloride CAS Name: 2-(1-imidazolylmethyl)-2H-1-benzopyran-6-carboxylate hydrochloride IUPAC Name: 2-(imidazol-1-ylmethyl)-2H-chromene-6-carboxylate hydrochloride Traditional Name: 2-(imidazol-1-ylmethyl)-2H-chromene-6-carboxylate hydrochloride Formula: C14H12ClN2O3- MolecularWeight: 291.70968

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=CC(=C2)C(=O)[O-])OC1CN3C=CN=C3.Cl

Isomeric SMILES

C1=CC2=C(C=CC(=C2)C(=O)[O-])OC1CN3C=CN=C3.Cl

InChI

InChI=1S/C14H12N2O3.ClH/c17-14(18)11-2-4-13-10(7-11)1-3-12(19-13)8-16-6-5-15-9-16;/h1-7,9,12H,8H2,(H,17,18);1H/p-1