N-(cyanomethyl)-4-methyl-2-[3-[4-(1H-pyrrol-2-ylmethoxy)phenyl]phenyl]pentanamide

Systemtic Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(1H-pyrrol-2-ylmethoxy)phenyl]phenyl]pentanamide Openeye Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(1H-pyrrol-2-ylmethoxy)phenyl]phenyl]pentanamide CAS Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(1H-pyrrol-2-ylmethoxy)phenyl]phenyl]pentanamide IUPAC Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(1H-pyrrol-2-ylmethoxy)phenyl]phenyl]pentanamide Traditional Name: N-(cyanomethyl)-4-methyl-2-[3-[4-(1H-pyrrol-2-ylmethoxy)phenyl]phenyl]valeramide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)OCC3=CC=CN3)C(=O)NCC#N

Isomeric SMILES

CC(C)CC(C1=CC=CC(=C1)C2=CC=C(C=C2)OCC3=CC=CN3)C(=O)NCC#N

InChI

InChI=1S/C25H27N3O2/c1-18(2)15-24(25(29)28-14-12-26)21-6-3-5-20(16-21)19-8-10-23(11-9-19)30-17-22-7-4-13-27-22/h3-11,13,16,18,24,27H,14-15,17H2,1-2H3,(H,28,29)