2-(benzotriazol-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]ethanone

Systemtic Name: 2-(benzotriazol-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Openeye Name: 2-(benzotriazol-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]ethanone CAS Name: 2-(1-benzotriazolyl)-1-[2-(2,5-dimethoxyphenyl)-1-pyrrolidinyl]ethanone IUPAC Name: 2-(benzotriazol-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidin-1-yl]ethanone Traditional Name: 2-(benzotriazol-1-yl)-1-[2-(2,5-dimethoxyphenyl)pyrrolidino]ethanone Formula: C20H22N4O3 MolecularWeight: 366.41368

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CN3C4=CC=CC=C4N=N3

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2CCCN2C(=O)CN3C4=CC=CC=C4N=N3

InChI

InChI=1S/C20H22N4O3/c1-26-14-9-10-19(27-2)15(12-14)17-8-5-11-23(17)20(25)13-24-18-7-4-3-6-16(18)21-22-24/h3-4,6-7,9-10,12,17H,5,8,11,13H2,1-2H3