5-[[(2S)-2-ethylhexanoyl]amino]-N-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-yl-benzamide

Systemtic Name: 5-[[(2S)-2-ethylhexanoyl]amino]-N-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-yl-benzamide Openeye Name: 5-[[(2S)-2-ethylhexanoyl]amino]-2-pyrrolidin-1-yl-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide CAS Name: 5-[[(2S)-2-ethyl-1-oxohexyl]amino]-N-[[(2R)-2-oxolanyl]methyl]-2-(1-pyrrolidinyl)benzamide IUPAC Name: 5-[[(2S)-2-ethylhexanoyl]amino]-N-[[(2R)-oxolan-2-yl]methyl]-2-pyrrolidin-1-ylbenzamide Traditional Name: 5-[[(2S)-2-ethylhexanoyl]amino]-2-pyrrolidino-N-[[(2R)-tetrahydrofuran-2-yl]methyl]benzamide Formula: C24H37N3O3 MolecularWeight: 415.56888

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NCC3CCCO3

Isomeric SMILES

CCCC[C@H](CC)C(=O)NC1=CC(=C(C=C1)N2CCCC2)C(=O)NC[C@H]3CCCO3

InChI

InChI=1S/C24H37N3O3/c1-3-5-9-18(4-2)23(28)26-19-11-12-22(27-13-6-7-14-27)21(16-19)24(29)25-17-20-10-8-15-30-20/h11-12,16,18,20H,3-10,13-15,17H2,1-2H3,(H,25,29)(H,26,28)/t18-,20+/m0/s1