5-[(but-3-yn-2-ylamino)methyl]-8-methoxy-3-phenyl-chromen-2-one

Systemtic Name: 5-[(but-3-yn-2-ylamino)methyl]-8-methoxy-3-phenyl-chromen-2-one Openeye Name: 8-methoxy-5-[(1-methylprop-2-ynylamino)methyl]-3-phenyl-chromen-2-one CAS Name: 5-[(but-3-yn-2-ylamino)methyl]-8-methoxy-3-phenyl-1-benzopyran-2-one IUPAC Name: 5-[(but-3-yn-2-ylamino)methyl]-8-methoxy-3-phenylchromen-2-one Traditional Name: 8-methoxy-5-[(1-methylprop-2-ynylamino)methyl]-3-phenyl-coumarin Formula: C21H19NO3 MolecularWeight: 333.38046

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#C)NCC1=C2C=C(C(=O)OC2=C(C=C1)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C#C)NCC1=C2C=C(C(=O)OC2=C(C=C1)OC)C3=CC=CC=C3

InChI

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