6,7-dimethoxy-3-[(phenylmethyl)amino]-3H-2-benzofuran-1-one

Systemtic Name: 6,7-dimethoxy-3-[(phenylmethyl)amino]-3H-2-benzofuran-1-one Openeye Name: 3-(benzylamino)-6,7-dimethoxy-3H-isobenzofuran-1-one CAS Name: 6,7-dimethoxy-3-[(phenylmethyl)amino]-3H-isobenzofuran-1-one IUPAC Name: 3-(benzylamino)-6,7-dimethoxy-3H-2-benzofuran-1-one Traditional Name: 3-(benzylamino)-6,7-dimethoxy-phthalide Formula: C17H17NO4 MolecularWeight: 299.32118

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C2=C(C=C1)C(OC2=O)NCC3=CC=CC=C3)OC

Isomeric SMILES

COC1=C(C2=C(C=C1)C(OC2=O)NCC3=CC=CC=C3)OC

InChI

InChI=1S/C17H17NO4/c1-20-13-9-8-12-14(15(13)21-2)17(19)22-16(12)18-10-11-6-4-3-5-7-11/h3-9,16,18H,10H2,1-2H3