5-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylcarbamoyl)pyridine-2-carboxylic acid

Systemtic Name: 5-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylcarbamoyl)pyridine-2-carboxylic acid Openeye Name: 5-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylcarbamoyl)pyridine-2-carboxylic acid CAS Name: 5-[oxo-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylamino)methyl]-2-pyridinecarboxylic acid IUPAC Name: 5-(6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-ylcarbamoyl)pyridine-2-carboxylic acid Traditional Name: 5-(6,7,8,9-tetrahydro-5H-benzocyclohepten-6-ylcarbamoyl)picolinic acid Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC2=CC=CC=C2C1)NC(=O)C3=CN=C(C=C3)C(=O)O

Isomeric SMILES

C1CC(CC2=CC=CC=C2C1)NC(=O)C3=CN=C(C=C3)C(=O)O

InChI

InChI=1S/C18H18N2O3/c21-17(14-8-9-16(18(22)23)19-11-14)20-15-7-3-6-12-4-1-2-5-13(12)10-15/h1-2,4-5,8-9,11,15H,3,6-7,10H2,(H,20,21)(H,22,23)