3-[[3-oxidanyl-2-oxidanylidene-1-(phenylmethyl)pyridin-4-yl]methylamino]azepan-2-one

Systemtic Name: 3-[[3-oxidanyl-2-oxidanylidene-1-(phenylmethyl)pyridin-4-yl]methylamino]azepan-2-one Openeye Name: 3-[(1-benzyl-3-hydroxy-2-oxo-4-pyridyl)methylamino]azepan-2-one CAS Name: 3-[[3-hydroxy-2-oxo-1-(phenylmethyl)-4-pyridinyl]methylamino]-2-azepanone IUPAC Name: 3-[(1-benzyl-3-hydroxy-2-oxopyridin-4-yl)methylamino]azepan-2-one Traditional Name: 3-[(1-benzyl-3-hydroxy-2-keto-4-pyridyl)methylamino]azepan-2-one Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NCC2=C(C(=O)N(C=C2)CC3=CC=CC=C3)O

Isomeric SMILES

C1CCNC(=O)C(C1)NCC2=C(C(=O)N(C=C2)CC3=CC=CC=C3)O

InChI

InChI=1S/C19H23N3O3/c23-17-15(12-21-16-8-4-5-10-20-18(16)24)9-11-22(19(17)25)13-14-6-2-1-3-7-14/h1-3,6-7,9,11,16,21,23H,4-5,8,10,12-13H2,(H,20,24)