7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid

Systemtic Name: 7-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid Openeye Name: 7-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid CAS Name: 7-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoethyl]amino]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid IUPAC Name: 7-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]-3,4-dihydro-2H-1,5-benzodioxepine-8-carboxylic acid Traditional Name: 7-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]-3,4-dihydro-2H-1,5-benzodioxepin-8-carboxylic acid Formula: C20H19NO7 MolecularWeight: 385.36736

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C(=C2)C(=O)O)NC(=O)CC3=CC4=C(C=C3)OCCO4)OC1

Isomeric SMILES

C1COC2=C(C=C(C(=C2)C(=O)O)NC(=O)CC3=CC4=C(C=C3)OCCO4)OC1

InChI

InChI=1S/C20H19NO7/c22-19(9-12-2-3-15-16(8-12)28-7-6-27-15)21-14-11-18-17(10-13(14)20(23)24)25-4-1-5-26-18/h2-3,8,10-11H,1,4-7,9H2,(H,21,22)(H,23,24)