2-[3-pyridin-2-yl-1-(3,4,5-trimethoxyphenyl)carbonyl-pyrrolidin-3-yl]ethanal

Systemtic Name: 2-[3-pyridin-2-yl-1-(3,4,5-trimethoxyphenyl)carbonyl-pyrrolidin-3-yl]ethanal Openeye Name: 2-[3-(2-pyridyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]acetaldehyde CAS Name: 2-[1-[oxo-(3,4,5-trimethoxyphenyl)methyl]-3-(2-pyridinyl)-3-pyrrolidinyl]acetaldehyde IUPAC Name: 2-[3-pyridin-2-yl-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]acetaldehyde Traditional Name: 2-[3-(2-pyridyl)-1-(3,4,5-trimethoxybenzoyl)pyrrolidin-3-yl]acetaldehyde Formula: C21H24N2O5 MolecularWeight: 384.42566

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(C2)(CC=O)C3=CC=CC=N3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N2CCC(C2)(CC=O)C3=CC=CC=N3

InChI

InChI=1S/C21H24N2O5/c1-26-16-12-15(13-17(27-2)19(16)28-3)20(25)23-10-7-21(14-23,8-11-24)18-6-4-5-9-22-18/h4-6,9,11-13H,7-8,10,14H2,1-3H3