N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-(3,4,5-trimethoxyphenyl)propanamide

Systemtic Name: N-(5-chloranyl-2-pyrrolidin-1-yl-phenyl)-3-(3,4,5-trimethoxyphenyl)propanamide Openeye Name: N-(5-chloro-2-pyrrolidin-1-yl-phenyl)-3-(3,4,5-trimethoxyphenyl)propanamide CAS Name: N-[5-chloro-2-(1-pyrrolidinyl)phenyl]-3-(3,4,5-trimethoxyphenyl)propanamide IUPAC Name: N-(5-chloro-2-pyrrolidin-1-ylphenyl)-3-(3,4,5-trimethoxyphenyl)propanamide Traditional Name: N-(5-chloro-2-pyrrolidino-phenyl)-3-(3,4,5-trimethoxyphenyl)propionamide Formula: C22H27ClN2O4 MolecularWeight: 418.91378

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2=C(C=CC(=C2)Cl)N3CCCC3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)NC2=C(C=CC(=C2)Cl)N3CCCC3

InChI

InChI=1S/C22H27ClN2O4/c1-27-19-12-15(13-20(28-2)22(19)29-3)6-9-21(26)24-17-14-16(23)7-8-18(17)25-10-4-5-11-25/h7-8,12-14H,4-6,9-11H2,1-3H3,(H,24,26)