3-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxidanylidene-propyl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[3-[3-(1,3-benzoxazol-2-yl)-1-piperidyl]-3-oxo-propyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[3-[3-(1,3-benzoxazol-2-yl)-1-piperidinyl]-3-oxopropyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[3-[3-(1,3-benzoxazol-2-yl)piperidin-1-yl]-3-oxopropyl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[3-[3-(1,3-benzoxazol-2-yl)piperidino]-3-keto-propyl]-1,2,3-benzotriazin-4-one Formula: C22H21N5O3 MolecularWeight: 403.43384

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3N=N2)C4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CC(CN(C1)C(=O)CCN2C(=O)C3=CC=CC=C3N=N2)C4=NC5=CC=CC=C5O4

InChI

InChI=1S/C22H21N5O3/c28-20(11-13-27-22(29)16-7-1-2-8-17(16)24-25-27)26-12-5-6-15(14-26)21-23-18-9-3-4-10-19(18)30-21/h1-4,7-10,15H,5-6,11-14H2