2-phenyl-3-[5-(propan-2-ylamino)pentoxy]-3H-isoindol-1-one

Systemtic Name: 2-phenyl-3-[5-(propan-2-ylamino)pentoxy]-3H-isoindol-1-one Openeye Name: 3-[5-(isopropylamino)pentoxy]-2-phenyl-isoindolin-1-one CAS Name: 2-phenyl-3-[5-(propan-2-ylamino)pentoxy]-3H-isoindol-1-one IUPAC Name: 2-phenyl-3-[5-(propan-2-ylamino)pentoxy]-3H-isoindol-1-one Traditional Name: 3-[5-(isopropylamino)pentoxy]-2-phenyl-isoindolin-1-one Formula: C22H28N2O2 MolecularWeight: 352.46992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCCCOC1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CC(C)NCCCCCOC1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C22H28N2O2/c1-17(2)23-15-9-4-10-16-26-22-20-14-8-7-13-19(20)21(25)24(22)18-11-5-3-6-12-18/h3,5-8,11-14,17,22-23H,4,9-10,15-16H2,1-2H3