2-(3-carboxy-2-oxidanylidene-cyclohepta[b]pyrrol-1-yl)butanedioic acid

Systemtic Name: 2-(3-carboxy-2-oxidanylidene-cyclohepta[b]pyrrol-1-yl)butanedioic acid Openeye Name: 2-(3-carboxy-2-oxo-cyclohepta[b]pyrrol-1-yl)butanedioic acid CAS Name: 2-(3-carboxy-2-oxo-1-cyclohepta[b]pyrrolyl)butanedioic acid IUPAC Name: 2-(3-carboxy-2-oxocyclohepta[b]pyrrol-1-yl)butanedioic acid Traditional Name: 2-(3-carboxy-2-keto-cyclohepta[b]pyrrol-1-yl)succinic acid Formula: C14H11NO7 MolecularWeight: 305.23964

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C(C(=O)N2C(CC(=O)O)C(=O)O)C(=O)O)C=C1

Isomeric SMILES

C1=CC=C2C(=C(C(=O)N2C(CC(=O)O)C(=O)O)C(=O)O)C=C1

InChI

InChI=1S/C14H11NO7/c16-10(17)6-9(13(19)20)15-8-5-3-1-2-4-7(8)11(12(15)18)14(21)22/h1-5,9H,6H2,(H,16,17)(H,19,20)(H,21,22)