(Z)-6-(4-azanyl-6,7-dimethyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid

Systemtic Name: (Z)-6-(4-azanyl-6,7-dimethyl-3-oxidanylidene-1H-2-benzofuran-5-yl)-4-methyl-hex-4-enoic acid Openeye Name: (Z)-6-(4-amino-6,7-dimethyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-hex-4-enoic acid CAS Name: (Z)-6-(4-amino-6,7-dimethyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid IUPAC Name: (Z)-6-(4-amino-6,7-dimethyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid Traditional Name: (Z)-6-(4-amino-3-keto-6,7-dimethyl-phthalan-5-yl)-4-methyl-hex-4-enoic acid Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)N)CC=C(C)CCC(=O)O)C

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)N)C/C=C(/C)\CCC(=O)O)C

InChI

InChI=1S/C17H21NO4/c1-9(5-7-14(19)20)4-6-12-10(2)11(3)13-8-22-17(21)15(13)16(12)18/h4H,5-8,18H2,1-3H3,(H,19,20)/b9-4-