2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)pyridine-4-carboxylic acid

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)pyridine-4-carboxylic acid Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)pyridine-4-carboxylic acid CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-4-pyridinecarboxylic acid IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)pyridine-4-carboxylic acid Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)isonicotinic acid Formula: C15H14N2O4 MolecularWeight: 286.28266

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)NC3=NC=CC(=C3)C(=O)O)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)NC3=NC=CC(=C3)C(=O)O)OC1

InChI

InChI=1S/C15H14N2O4/c18-15(19)10-4-5-16-14(8-10)17-11-2-3-12-13(9-11)21-7-1-6-20-12/h2-5,8-9H,1,6-7H2,(H,16,17)(H,18,19)