3-[6-azanyl-1-(2-azanylethyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione

Systemtic Name: 3-[6-azanyl-1-(2-azanylethyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Openeye Name: 3-[6-amino-1-(2-aminoethyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione CAS Name: 3-[6-amino-1-(2-aminoethyl)-3-indolyl]-4-(1H-indol-3-yl)pyrrole-2,5-dione IUPAC Name: 3-[6-amino-1-(2-aminoethyl)indol-3-yl]-4-(1H-indol-3-yl)pyrrole-2,5-dione Traditional Name: 3-[6-amino-1-(2-aminoethyl)indol-3-yl]-4-(1H-indol-3-yl)-3-pyrroline-2,5-quinone Formula: C22H19N5O2 MolecularWeight: 385.41856

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2)C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)N)CCN

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2)C3=C(C(=O)NC3=O)C4=CN(C5=C4C=CC(=C5)N)CCN

InChI

InChI=1S/C22H19N5O2/c23-7-8-27-11-16(14-6-5-12(24)9-18(14)27)20-19(21(28)26-22(20)29)15-10-25-17-4-2-1-3-13(15)17/h1-6,9-11,25H,7-8,23-24H2,(H,26,28,29)