N-(cyanomethyl)-4-methyl-2-[3-(4-morpholin-4-ylcarbonylphenyl)phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-(4-morpholin-4-ylcarbonylphenyl)phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(morpholine-4-carbonyl)phenyl]phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-[4-[4-morpholinyl(oxo)methyl]phenyl]phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(morpholine-4-carbonyl)phenyl]phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(morpholine-4-carbonyl)phenyl]phenyl]valeramide Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)N3CCOCC3)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)C(=O)N3CCOCC3)C(=O)NCC#N

InChI

InChI=1S/C25H29N3O3/c1-18(2)16-23(24(29)27-11-10-26)22-5-3-4-21(17-22)19-6-8-20(9-7-19)25(30)28-12-14-31-15-13-28/h3-9,17-18,23H,11-16H2,1-2H3,(H,27,29)