(2S)-N-[4-(dimethylamino)-3-pyrrolidin-1-ylcarbonyl-phenyl]-2-ethyl-hexanamide

Systemtic Name: (2S)-N-[4-(dimethylamino)-3-pyrrolidin-1-ylcarbonyl-phenyl]-2-ethyl-hexanamide Openeye Name: (2S)-N-[4-(dimethylamino)-3-(pyrrolidine-1-carbonyl)phenyl]-2-ethyl-hexanamide CAS Name: (2S)-N-[4-(dimethylamino)-3-[oxo(1-pyrrolidinyl)methyl]phenyl]-2-ethylhexanamide IUPAC Name: (2S)-N-[4-(dimethylamino)-3-(pyrrolidine-1-carbonyl)phenyl]-2-ethylhexanamide Traditional Name: (2S)-N-[4-(dimethylamino)-3-(pyrrolidine-1-carbonyl)phenyl]-2-ethyl-hexanamide Formula: C21H33N3O2 MolecularWeight: 359.50562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N(C)C)C(=O)N2CCCC2

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=CC(=C(C=C1)N(C)C)C(=O)N2CCCC2

InChI

InChI=1S/C21H33N3O2/c1-5-7-10-16(6-2)20(25)22-17-11-12-19(23(3)4)18(15-17)21(26)24-13-8-9-14-24/h11-12,15-16H,5-10,13-14H2,1-4H3,(H,22,25)/t16-/m0/s1