N-[2-(azepan-1-yl)phenyl]-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide

Systemtic Name: N-[2-(azepan-1-yl)phenyl]-5-oxidanylidene-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Openeye Name: N-[2-(azepan-1-yl)phenyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide CAS Name: N-[2-(1-azepanyl)phenyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)-3-pyrrolidinecarboxamide IUPAC Name: N-[2-(azepan-1-yl)phenyl]-5-oxo-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Traditional Name: N-[2-(azepan-1-yl)phenyl]-5-keto-1-(3,4,5-trimethoxyphenyl)pyrrolidine-3-carboxamide Formula: C26H33N3O5 MolecularWeight: 467.55732

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)NC3=CC=CC=C3N4CCCCCC4

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)N2CC(CC2=O)C(=O)NC3=CC=CC=C3N4CCCCCC4

InChI

InChI=1S/C26H33N3O5/c1-32-22-15-19(16-23(33-2)25(22)34-3)29-17-18(14-24(29)30)26(31)27-20-10-6-7-11-21(20)28-12-8-4-5-9-13-28/h6-7,10-11,15-16,18H,4-5,8-9,12-14,17H2,1-3H3,(H,27,31)