4-hexoxy-N-[(2S)-1-oxidanylidene-1-(3-pyrrolidin-1-ylpropylamino)pentan-2-yl]benzamide

Systemtic Name: 4-hexoxy-N-[(2S)-1-oxidanylidene-1-(3-pyrrolidin-1-ylpropylamino)pentan-2-yl]benzamide Openeye Name: 4-hexoxy-N-[(1S)-1-(3-pyrrolidin-1-ylpropylcarbamoyl)butyl]benzamide CAS Name: 4-hexoxy-N-[(2S)-1-oxo-1-[3-(1-pyrrolidinyl)propylamino]pentan-2-yl]benzamide IUPAC Name: 4-hexoxy-N-[(2S)-1-oxo-1-(3-pyrrolidin-1-ylpropylamino)pentan-2-yl]benzamide Traditional Name: 4-hexoxy-N-[(1S)-1-(3-pyrrolidinopropylcarbamoyl)butyl]benzamide Formula: C25H41N3O3 MolecularWeight: 431.61134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(CCC)C(=O)NCCCN2CCCC2

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)N[C@@H](CCC)C(=O)NCCCN2CCCC2

InChI

InChI=1S/C25H41N3O3/c1-3-5-6-9-20-31-22-14-12-21(13-15-22)24(29)27-23(11-4-2)25(30)26-16-10-19-28-17-7-8-18-28/h12-15,23H,3-11,16-20H2,1-2H3,(H,26,30)(H,27,29)/t23-/m0/s1