[4-(benzotriazol-1-yl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone

Systemtic Name: [4-(benzotriazol-1-yl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Openeye Name: [4-(benzotriazol-1-yl)-1-piperidyl]-(3,4,5-trimethoxyphenyl)methanone CAS Name: [4-(1-benzotriazolyl)-1-piperidinyl]-(3,4,5-trimethoxyphenyl)methanone IUPAC Name: [4-(benzotriazol-1-yl)piperidin-1-yl]-(3,4,5-trimethoxyphenyl)methanone Traditional Name: [4-(benzotriazol-1-yl)piperidino]-(3,4,5-trimethoxyphenyl)methanone Formula: C21H24N4O4 MolecularWeight: 396.43966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)N3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(CC2)N3C4=CC=CC=C4N=N3

InChI

InChI=1S/C21H24N4O4/c1-27-18-12-14(13-19(28-2)20(18)29-3)21(26)24-10-8-15(9-11-24)25-17-7-5-4-6-16(17)22-23-25/h4-7,12-13,15H,8-11H2,1-3H3