6-[4-(dipropylamino)butylamino]-5-methyl-4-(phenylmethyl)isoindole-1,3-dione

Systemtic Name: 6-[4-(dipropylamino)butylamino]-5-methyl-4-(phenylmethyl)isoindole-1,3-dione Openeye Name: 4-benzyl-6-[4-(dipropylamino)butylamino]-5-methyl-isoindoline-1,3-dione CAS Name: 6-[4-(dipropylamino)butylamino]-5-methyl-4-(phenylmethyl)isoindole-1,3-dione IUPAC Name: 4-benzyl-6-[4-(dipropylamino)butylamino]-5-methylisoindole-1,3-dione Traditional Name: 4-benzyl-6-[4-(dipropylamino)butylamino]-5-methyl-isoindoline-1,3-quinone Formula: C26H35N3O2 MolecularWeight: 421.575

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(CCC)CCCCNC1=C(C(=C2C(=C1)C(=O)NC2=O)CC3=CC=CC=C3)C

Isomeric SMILES

CCCN(CCC)CCCCNC1=C(C(=C2C(=C1)C(=O)NC2=O)CC3=CC=CC=C3)C

InChI

InChI=1S/C26H35N3O2/c1-4-14-29(15-5-2)16-10-9-13-27-23-18-22-24(26(31)28-25(22)30)21(19(23)3)17-20-11-7-6-8-12-20/h6-8,11-12,18,27H,4-5,9-10,13-17H2,1-3H3,(H,28,30,31)