2-[4-(1H-indol-3-yl)butan-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione

Systemtic Name: 2-[4-(1H-indol-3-yl)butan-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Openeye Name: 2-[3-(1H-indol-3-yl)-1-methyl-propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione CAS Name: 2-[4-(1H-indol-3-yl)butan-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione IUPAC Name: 2-[4-(1H-indol-3-yl)butan-2-yl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione Traditional Name: 2-[3-(1H-indol-3-yl)-1-methyl-propyl]-3a,4,7,7a-tetrahydroisoindole-1,3-quinone Formula: C20H22N2O2 MolecularWeight: 322.40088

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CNC2=CC=CC=C21)N3C(=O)C4CC=CCC4C3=O

Isomeric SMILES

CC(CCC1=CNC2=CC=CC=C21)N3C(=O)C4CC=CCC4C3=O

InChI

InChI=1S/C20H22N2O2/c1-13(10-11-14-12-21-18-9-5-4-6-15(14)18)22-19(23)16-7-2-3-8-17(16)20(22)24/h2-6,9,12-13,16-17,21H,7-8,10-11H2,1H3