6-azanyl-3-(3-butoxyphenyl)-3H-2-benzofuran-1-one

Systemtic Name: 6-azanyl-3-(3-butoxyphenyl)-3H-2-benzofuran-1-one Openeye Name: 6-amino-3-(3-butoxyphenyl)-3H-isobenzofuran-1-one CAS Name: 6-amino-3-(3-butoxyphenyl)-3H-isobenzofuran-1-one IUPAC Name: 6-amino-3-(3-butoxyphenyl)-3H-2-benzofuran-1-one Traditional Name: 6-amino-3-(3-butoxyphenyl)phthalide Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C2C3=C(C=C(C=C3)N)C(=O)O2

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C2C3=C(C=C(C=C3)N)C(=O)O2

InChI

InChI=1S/C18H19NO3/c1-2-3-9-21-14-6-4-5-12(10-14)17-15-8-7-13(19)11-16(15)18(20)22-17/h4-8,10-11,17H,2-3,9,19H2,1H3