3-chloranyl-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]adamantane-1-carboxamide

Systemtic Name: 3-chloranyl-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]adamantane-1-carboxamide Openeye Name: 3-chloro-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]adamantane-1-carboxamide CAS Name: 3-chloro-N-[2-(3-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-1-adamantanecarboxamide IUPAC Name: 3-chloro-N-[2-(3-methoxyphenyl)-2-pyrrolidin-1-ylethyl]adamantane-1-carboxamide Traditional Name: 3-chloro-N-[2-(3-methoxyphenyl)-2-pyrrolidino-ethyl]adamantane-1-carboxamide Formula: C24H33ClN2O2 MolecularWeight: 416.98402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(CNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)N5CCCC5

Isomeric SMILES

COC1=CC=CC(=C1)C(CNC(=O)C23CC4CC(C2)CC(C4)(C3)Cl)N5CCCC5

InChI

InChI=1S/C24H33ClN2O2/c1-29-20-6-4-5-19(10-20)21(27-7-2-3-8-27)15-26-22(28)23-11-17-9-18(12-23)14-24(25,13-17)16-23/h4-6,10,17-18,21H,2-3,7-9,11-16H2,1H3,(H,26,28)