3-(1-methylpyrrol-3-yl)-1-[2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]propan-1-one

Systemtic Name: 3-(1-methylpyrrol-3-yl)-1-[2-[2-oxidanyl-3-(propan-2-ylamino)propoxy]phenyl]propan-1-one Openeye Name: 1-[2-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-3-(1-methylpyrrol-3-yl)propan-1-one CAS Name: 1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-(1-methyl-3-pyrrolyl)-1-propanone IUPAC Name: 1-[2-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]-3-(1-methylpyrrol-3-yl)propan-1-one Traditional Name: 1-[2-[2-hydroxy-3-(isopropylamino)propoxy]phenyl]-3-(1-methylpyrrol-3-yl)propan-1-one Formula: C20H28N2O3 MolecularWeight: 344.44792

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=CC=CC=C1C(=O)CCC2=CN(C=C2)C)O

Isomeric SMILES

CC(C)NCC(COC1=CC=CC=C1C(=O)CCC2=CN(C=C2)C)O

InChI

InChI=1S/C20H28N2O3/c1-15(2)21-12-17(23)14-25-20-7-5-4-6-18(20)19(24)9-8-16-10-11-22(3)13-16/h4-7,10-11,13,15,17,21,23H,8-9,12,14H2,1-3H3