4-cyano-N-[(3S)-1-[3-(4-ethanoylphenoxy)propyl]pyrrolidin-3-yl]benzamide

Systemtic Name: 4-cyano-N-[(3S)-1-[3-(4-ethanoylphenoxy)propyl]pyrrolidin-3-yl]benzamide Openeye Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]pyrrolidin-3-yl]-4-cyano-benzamide CAS Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]-3-pyrrolidinyl]-4-cyanobenzamide IUPAC Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]pyrrolidin-3-yl]-4-cyanobenzamide Traditional Name: N-[(3S)-1-[3-(4-acetylphenoxy)propyl]pyrrolidin-3-yl]-4-cyano-benzamide Formula: C23H25N3O3 MolecularWeight: 391.4629

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)OCCCN2CCC(C2)NC(=O)C3=CC=C(C=C3)C#N

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)OCCCN2CC[C@@H](C2)NC(=O)C3=CC=C(C=C3)C#N

InChI

InChI=1S/C23H25N3O3/c1-17(27)19-7-9-22(10-8-19)29-14-2-12-26-13-11-21(16-26)25-23(28)20-5-3-18(15-24)4-6-20/h3-10,21H,2,11-14,16H2,1H3,(H,25,28)/t21-/m0/s1