5-(2-hydroxyethylamino)-3-(hydroxymethyl)-1-methyl-2-phenyl-indole-4,7-dione

Systemtic Name: 5-(2-hydroxyethylamino)-3-(hydroxymethyl)-1-methyl-2-phenyl-indole-4,7-dione Openeye Name: 5-(2-hydroxyethylamino)-3-(hydroxymethyl)-1-methyl-2-phenyl-indole-4,7-dione CAS Name: 5-(2-hydroxyethylamino)-3-(hydroxymethyl)-1-methyl-2-phenylindole-4,7-dione IUPAC Name: 5-(2-hydroxyethylamino)-3-(hydroxymethyl)-1-methyl-2-phenylindole-4,7-dione Traditional Name: 5-(2-hydroxyethylamino)-1-methyl-3-methylol-2-phenyl-indole-4,7-quinone Formula: C18H18N2O4 MolecularWeight: 326.34652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C1C(=O)C=C(C2=O)NCCO)CO)C3=CC=CC=C3

Isomeric SMILES

CN1C(=C(C2=C1C(=O)C=C(C2=O)NCCO)CO)C3=CC=CC=C3

InChI

InChI=1S/C18H18N2O4/c1-20-16(11-5-3-2-4-6-11)12(10-22)15-17(20)14(23)9-13(18(15)24)19-7-8-21/h2-6,9,19,21-22H,7-8,10H2,1H3