(E)-2-(4-azanyl-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid

Systemtic Name: (E)-2-(4-azanyl-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid Openeye Name: (E)-2-(4-amino-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: (E)-2-(4-amino-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: (E)-2-(4-amino-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: (E)-2-(4-amino-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

CC=C(C)CC(C1=C(C2=C(COC2=O)C(=C1OC)C)N)C(=O)O

Isomeric SMILES

C/C=C(\C)/CC(C1=C(C2=C(COC2=O)C(=C1OC)C)N)C(=O)O

InChI

InChI=1S/C17H21NO5/c1-5-8(2)6-10(16(19)20)12-14(18)13-11(7-23-17(13)21)9(3)15(12)22-4/h5,10H,6-7,18H2,1-4H3,(H,19,20)/b8-5+