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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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