1-(naphthalen-2-ylcarbamoyl)azepane-4-carboxylic acid

Systemtic Name: 1-(naphthalen-2-ylcarbamoyl)azepane-4-carboxylic acid Openeye Name: 1-(2-naphthylcarbamoyl)azepane-4-carboxylic acid CAS Name: 1-[(2-naphthalenylamino)-oxomethyl]-4-azepanecarboxylic acid IUPAC Name: 1-(naphthalen-2-ylcarbamoyl)azepane-4-carboxylic acid Traditional Name: 1-(2-naphthylcarbamoyl)azepane-4-carboxylic acid Formula: C18H20N2O3 MolecularWeight: 312.363

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCN(C1)C(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)O

Isomeric SMILES

C1CC(CCN(C1)C(=O)NC2=CC3=CC=CC=C3C=C2)C(=O)O

InChI

InChI=1S/C18H20N2O3/c21-17(22)14-6-3-10-20(11-9-14)18(23)19-16-8-7-13-4-1-2-5-15(13)12-16/h1-2,4-5,7-8,12,14H,3,6,9-11H2,(H,19,23)(H,21,22)