8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenyl-chromen-2-one hydrochloride

Systemtic Name: 8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenyl-chromen-2-one hydrochloride Openeye Name: 8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenyl-chromen-2-one hydrochloride CAS Name: 8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenyl-1-benzopyran-2-one hydrochloride IUPAC Name: 8-methoxy-5-[[methyl(prop-2-ynyl)amino]methyl]-3-phenylchromen-2-one hydrochloride Traditional Name: 8-methoxy-5-[[methyl(propargyl)amino]methyl]-3-phenyl-coumarin hydrochloride Formula: C21H20ClNO3 MolecularWeight: 369.8414

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC#C)CC1=C2C=C(C(=O)OC2=C(C=C1)OC)C3=CC=CC=C3.Cl

Isomeric SMILES

CN(CC#C)CC1=C2C=C(C(=O)OC2=C(C=C1)OC)C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H19NO3.ClH/c1-4-12-22(2)14-16-10-11-19(24-3)20-17(16)13-18(21(23)25-20)15-8-6-5-7-9-15;/h1,5-11,13H,12,14H2,2-3H3;1H