1-[(E)-4-(4-azanyl-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)but-2-en-2-yl]cyclopentane-1-carboxylic acid

Systemtic Name: 1-[(E)-4-(4-azanyl-6-methoxy-7-methyl-3-oxidanylidene-1H-2-benzofuran-5-yl)but-2-en-2-yl]cyclopentane-1-carboxylic acid Openeye Name: 1-[(E)-3-(4-amino-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-1-methyl-prop-1-enyl]cyclopentanecarboxylic acid CAS Name: 1-[(E)-4-(4-amino-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)but-2-en-2-yl]-1-cyclopentanecarboxylic acid IUPAC Name: 1-[(E)-4-(4-amino-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)but-2-en-2-yl]cyclopentane-1-carboxylic acid Traditional Name: 1-[(E)-3-(4-amino-3-keto-6-methoxy-7-methyl-phthalan-5-yl)-1-methyl-prop-1-enyl]cyclopentanecarboxylic acid Formula: C20H25NO5 MolecularWeight: 359.4162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C2=C1COC2=O)N)CC=C(C)C3(CCCC3)C(=O)O)OC

Isomeric SMILES

CC1=C(C(=C(C2=C1COC2=O)N)C/C=C(\C)/C3(CCCC3)C(=O)O)OC

InChI

InChI=1S/C20H25NO5/c1-11(20(19(23)24)8-4-5-9-20)6-7-13-16(21)15-14(10-26-18(15)22)12(2)17(13)25-3/h6H,4-5,7-10,21H2,1-3H3,(H,23,24)/b11-6+