(Z)-6-[4-azanyl-6-[(4-methoxyphenyl)methoxymethyl]-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoic acid

Systemtic Name: (Z)-6-[4-azanyl-6-[(4-methoxyphenyl)methoxymethyl]-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl]-4-methyl-hex-4-enoic acid Openeye Name: (Z)-6-[4-amino-6-[(4-methoxyphenyl)methoxymethyl]-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-hex-4-enoic acid CAS Name: (Z)-6-[4-amino-6-[(4-methoxyphenyl)methoxymethyl]-7-methyl-3-oxo-1H-isobenzofuran-5-yl]-4-methyl-4-hexenoic acid IUPAC Name: (Z)-6-[4-amino-6-[(4-methoxyphenyl)methoxymethyl]-7-methyl-3-oxo-1H-2-benzofuran-5-yl]-4-methylhex-4-enoic acid Traditional Name: (Z)-6-[4-amino-3-keto-7-methyl-6-(p-anisyloxymethyl)phthalan-5-yl]-4-methyl-hex-4-enoic acid Formula: C25H29NO6 MolecularWeight: 439.50086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)N)CC=C(C)CCC(=O)O)COCC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)N)C/C=C(/C)\CCC(=O)O)COCC3=CC=C(C=C3)OC

InChI

InChI=1S/C25H29NO6/c1-15(5-11-22(27)28)4-10-19-20(13-31-12-17-6-8-18(30-3)9-7-17)16(2)21-14-32-25(29)23(21)24(19)26/h4,6-9H,5,10-14,26H2,1-3H3,(H,27,28)/b15-4-