4-[[(4-methylphenyl)amino]methyl]-7-oxidanyl-chromen-2-one

Systemtic Name: 4-[[(4-methylphenyl)amino]methyl]-7-oxidanyl-chromen-2-one Openeye Name: 7-hydroxy-4-[(4-methylanilino)methyl]chromen-2-one CAS Name: 7-hydroxy-4-[(4-methylanilino)methyl]-1-benzopyran-2-one IUPAC Name: 7-hydroxy-4-[(4-methylanilino)methyl]chromen-2-one Traditional Name: 7-hydroxy-4-(p-toluidinomethyl)coumarin Formula: C17H15NO3 MolecularWeight: 281.3059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)NCC2=CC(=O)OC3=C2C=CC(=C3)O

InChI

InChI=1S/C17H15NO3/c1-11-2-4-13(5-3-11)18-10-12-8-17(20)21-16-9-14(19)6-7-15(12)16/h2-9,18-19H,10H2,1H3