3-[1-(3,5-dimethoxyphenyl)carbonylpiperidin-4-yl]-1,2,3-benzotriazin-4-one

Systemtic Name: 3-[1-(3,5-dimethoxyphenyl)carbonylpiperidin-4-yl]-1,2,3-benzotriazin-4-one Openeye Name: 3-[1-(3,5-dimethoxybenzoyl)-4-piperidyl]-1,2,3-benzotriazin-4-one CAS Name: 3-[1-[(3,5-dimethoxyphenyl)-oxomethyl]-4-piperidinyl]-1,2,3-benzotriazin-4-one IUPAC Name: 3-[1-(3,5-dimethoxybenzoyl)piperidin-4-yl]-1,2,3-benzotriazin-4-one Traditional Name: 3-[1-(3,5-dimethoxybenzoyl)-4-piperidyl]-1,2,3-benzotriazin-4-one Formula: C21H22N4O4 MolecularWeight: 394.42378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)N3C(=O)C4=CC=CC=C4N=N3)OC

Isomeric SMILES

COC1=CC(=CC(=C1)C(=O)N2CCC(CC2)N3C(=O)C4=CC=CC=C4N=N3)OC

InChI

InChI=1S/C21H22N4O4/c1-28-16-11-14(12-17(13-16)29-2)20(26)24-9-7-15(8-10-24)25-21(27)18-5-3-4-6-19(18)22-23-25/h3-6,11-13,15H,7-10H2,1-2H3