6,7-dimethyl-4-[[(3-propan-2-ylphenyl)amino]methyl]chromen-2-one

Systemtic Name: 6,7-dimethyl-4-[[(3-propan-2-ylphenyl)amino]methyl]chromen-2-one Openeye Name: 4-[(3-isopropylanilino)methyl]-6,7-dimethyl-chromen-2-one CAS Name: 6,7-dimethyl-4-[(3-propan-2-ylanilino)methyl]-1-benzopyran-2-one IUPAC Name: 6,7-dimethyl-4-[(3-propan-2-ylanilino)methyl]chromen-2-one Traditional Name: 4-[(3-isopropylanilino)methyl]-6,7-dimethyl-coumarin Formula: C21H23NO2 MolecularWeight: 321.41282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=CC=CC(=C3)C(C)C)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C(=CC(=O)O2)CNC3=CC=CC(=C3)C(C)C)C

InChI

InChI=1S/C21H23NO2/c1-13(2)16-6-5-7-18(10-16)22-12-17-11-21(23)24-20-9-15(4)14(3)8-19(17)20/h5-11,13,22H,12H2,1-4H3