3-[(2-oxidanylnaphthalen-1-yl)methylamino]azepan-2-one

Systemtic Name: 3-[(2-oxidanylnaphthalen-1-yl)methylamino]azepan-2-one Openeye Name: 3-[(2-hydroxy-1-naphthyl)methylamino]azepan-2-one CAS Name: 3-[(2-hydroxy-1-naphthalenyl)methylamino]-2-azepanone IUPAC Name: 3-[(2-hydroxynaphthalen-1-yl)methylamino]azepan-2-one Traditional Name: 3-[(2-hydroxy-1-naphthyl)methylamino]azepan-2-one Formula: C17H20N2O2 MolecularWeight: 284.3529

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=C(C=CC3=CC=CC=C32)O

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=C(C=CC3=CC=CC=C32)O

InChI

InChI=1S/C17H20N2O2/c20-16-9-8-12-5-1-2-6-13(12)14(16)11-19-15-7-3-4-10-18-17(15)21/h1-2,5-6,8-9,15,19-20H,3-4,7,10-11H2,(H,18,21)