1-naphthalen-2-ylcarbonylazepane-3-carboxylic acid

Systemtic Name: 1-naphthalen-2-ylcarbonylazepane-3-carboxylic acid Openeye Name: 1-(naphthalene-2-carbonyl)azepane-3-carboxylic acid CAS Name: 1-[2-naphthalenyl(oxo)methyl]-3-azepanecarboxylic acid IUPAC Name: 1-(naphthalene-2-carbonyl)azepane-3-carboxylic acid Traditional Name: 1-(2-naphthoyl)azepane-3-carboxylic acid Formula: C18H19NO3 MolecularWeight: 297.34836

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC(C1)C(=O)O)C(=O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C1CCN(CC(C1)C(=O)O)C(=O)C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H19NO3/c20-17(19-10-4-3-7-16(12-19)18(21)22)15-9-8-13-5-1-2-6-14(13)11-15/h1-2,5-6,8-9,11,16H,3-4,7,10,12H2,(H,21,22)