2-[2-(4,5-dimethoxycyclohexa-1,3-dien-1-yl)ethanoylamino]-5-oxidanyl-benzoic acid

Systemtic Name: 2-[2-(4,5-dimethoxycyclohexa-1,3-dien-1-yl)ethanoylamino]-5-oxidanyl-benzoic acid Openeye Name: 2-[[2-(4,5-dimethoxycyclohexa-1,3-dien-1-yl)acetyl]amino]-5-hydroxy-benzoic acid CAS Name: 2-[[2-(4,5-dimethoxy-1-cyclohexa-1,3-dienyl)-1-oxoethyl]amino]-5-hydroxybenzoic acid IUPAC Name: 2-[[2-(4,5-dimethoxycyclohexa-1,3-dien-1-yl)acetyl]amino]-5-hydroxybenzoic acid Traditional Name: 2-[[2-(4,5-dimethoxycyclohexa-1,3-dien-1-yl)acetyl]amino]-5-hydroxy-benzoic acid Formula: C17H19NO6 MolecularWeight: 333.33586

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Descriptors Computed from Structure

Canonical SMILES:

COC1CC(=CC=C1OC)CC(=O)NC2=C(C=C(C=C2)O)C(=O)O

Isomeric SMILES

COC1CC(=CC=C1OC)CC(=O)NC2=C(C=C(C=C2)O)C(=O)O

InChI

InChI=1S/C17H19NO6/c1-23-14-6-3-10(7-15(14)24-2)8-16(20)18-13-5-4-11(19)9-12(13)17(21)22/h3-6,9,15,19H,7-8H2,1-2H3,(H,18,20)(H,21,22)