N-[2-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide

Systemtic Name: N-[2-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxidanylidene-ethyl]adamantane-1-carboxamide Openeye Name: N-[2-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxo-ethyl]adamantane-1-carboxamide CAS Name: N-[2-[2-(3,4-dimethoxyphenyl)-1-pyrrolidinyl]-2-oxoethyl]-1-adamantanecarboxamide IUPAC Name: N-[2-[2-(3,4-dimethoxyphenyl)pyrrolidin-1-yl]-2-oxoethyl]adamantane-1-carboxamide Traditional Name: N-[2-[2-(3,4-dimethoxyphenyl)pyrrolidino]-2-keto-ethyl]adamantane-1-carboxamide Formula: C25H34N2O4 MolecularWeight: 426.54846

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CCCN2C(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CCCN2C(=O)CNC(=O)C34CC5CC(C3)CC(C5)C4)OC

InChI

InChI=1S/C25H34N2O4/c1-30-21-6-5-19(11-22(21)31-2)20-4-3-7-27(20)23(28)15-26-24(29)25-12-16-8-17(13-25)10-18(9-16)14-25/h5-6,11,16-18,20H,3-4,7-10,12-15H2,1-2H3,(H,26,29)