7-ethyl-4-[[(4-propan-2-ylphenyl)amino]methyl]chromen-2-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=CC=C(C=C3)C(C)C

Isomeric SMILES

CCC1=CC2=C(C=C1)C(=CC(=O)O2)CNC3=CC=C(C=C3)C(C)C

InChI

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