3-(hydroxymethyl)-1-methyl-5-(2-methylaziridin-1-yl)-2-propan-2-yl-indole-4,7-dione

Systemtic Name: 3-(hydroxymethyl)-1-methyl-5-(2-methylaziridin-1-yl)-2-propan-2-yl-indole-4,7-dione Openeye Name: 3-(hydroxymethyl)-2-isopropyl-1-methyl-5-(2-methylaziridin-1-yl)indole-4,7-dione CAS Name: 3-(hydroxymethyl)-1-methyl-5-(2-methyl-1-aziridinyl)-2-propan-2-ylindole-4,7-dione IUPAC Name: 3-(hydroxymethyl)-1-methyl-5-(2-methylaziridin-1-yl)-2-propan-2-ylindole-4,7-dione Traditional Name: 2-isopropyl-1-methyl-5-(2-methylethylenimin-1-yl)-3-methylol-indole-4,7-quinone Formula: C16H20N2O3 MolecularWeight: 288.3416

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN1C2=CC(=O)C3=C(C2=O)C(=C(N3C)C(C)C)CO

Isomeric SMILES

CC1CN1C2=CC(=O)C3=C(C2=O)C(=C(N3C)C(C)C)CO

InChI

InChI=1S/C16H20N2O3/c1-8(2)14-10(7-19)13-15(17(14)4)12(20)5-11(16(13)21)18-6-9(18)3/h5,8-9,19H,6-7H2,1-4H3