3-azanyl-4-[(3-methylphenyl)amino]isochromen-1-one

Systemtic Name: 3-azanyl-4-[(3-methylphenyl)amino]isochromen-1-one Openeye Name: 3-amino-4-(3-methylanilino)isochromen-1-one CAS Name: 3-amino-4-(3-methylanilino)-2-benzopyran-1-one IUPAC Name: 3-amino-4-(3-methylanilino)isochromen-1-one Traditional Name: 3-amino-4-(m-toluidino)isocoumarin Formula: C16H14N2O2 MolecularWeight: 266.29456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=C(OC(=O)C3=CC=CC=C32)N

Isomeric SMILES

CC1=CC(=CC=C1)NC2=C(OC(=O)C3=CC=CC=C32)N

InChI

InChI=1S/C16H14N2O2/c1-10-5-4-6-11(9-10)18-14-12-7-2-3-8-13(12)16(19)20-15(14)17/h2-9,18H,17H2,1H3