2-phenyl-3-[4-(propan-2-ylamino)butoxy]-3H-isoindol-1-one

Systemtic Name: 2-phenyl-3-[4-(propan-2-ylamino)butoxy]-3H-isoindol-1-one Openeye Name: 3-[4-(isopropylamino)butoxy]-2-phenyl-isoindolin-1-one CAS Name: 2-phenyl-3-[4-(propan-2-ylamino)butoxy]-3H-isoindol-1-one IUPAC Name: 2-phenyl-3-[4-(propan-2-ylamino)butoxy]-3H-isoindol-1-one Traditional Name: 3-[4-(isopropylamino)butoxy]-2-phenyl-isoindolin-1-one Formula: C21H26N2O2 MolecularWeight: 338.44334

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCCCCOC1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CC(C)NCCCCOC1C2=CC=CC=C2C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C21H26N2O2/c1-16(2)22-14-8-9-15-25-21-19-13-7-6-12-18(19)20(24)23(21)17-10-4-3-5-11-17/h3-7,10-13,16,21-22H,8-9,14-15H2,1-2H3