2-[6-acetamido-3-ethoxycarbonyl-4,9-bis(oxidanylidene)cyclohepta[b]pyridin-1-yl]ethanoic acid

Systemtic Name: 2-[6-acetamido-3-ethoxycarbonyl-4,9-bis(oxidanylidene)cyclohepta[b]pyridin-1-yl]ethanoic acid Openeye Name: 2-(6-acetamido-3-ethoxycarbonyl-4,9-dioxo-cyclohepta[b]pyridin-1-yl)acetic acid CAS Name: 2-(6-acetamido-3-ethoxycarbonyl-4,9-dioxo-1-cyclohepta[b]pyridinyl)acetic acid IUPAC Name: 2-(6-acetamido-3-ethoxycarbonyl-4,9-dioxocyclohepta[b]pyridin-1-yl)acetic acid Traditional Name: 2-(6-acetamido-3-carbethoxy-4,9-diketo-cyclohepta[b]pyridin-1-yl)acetic acid Formula: C17H16N2O7 MolecularWeight: 360.31814

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN(C2=C(C1=O)C=C(C=CC2=O)NC(=O)C)CC(=O)O

Isomeric SMILES

CCOC(=O)C1=CN(C2=C(C1=O)C=C(C=CC2=O)NC(=O)C)CC(=O)O

InChI

InChI=1S/C17H16N2O7/c1-3-26-17(25)12-7-19(8-14(22)23)15-11(16(12)24)6-10(18-9(2)20)4-5-13(15)21/h4-7H,3,8H2,1-2H3,(H,18,20)(H,22,23)