3-(hydroxymethyl)-1,2-dimethyl-5-[(2R)-2-methylaziridin-1-yl]indole-4,7-dione

Systemtic Name: 3-(hydroxymethyl)-1,2-dimethyl-5-[(2R)-2-methylaziridin-1-yl]indole-4,7-dione Openeye Name: 3-(hydroxymethyl)-1,2-dimethyl-5-[(2R)-2-methylaziridin-1-yl]indole-4,7-dione CAS Name: 3-(hydroxymethyl)-1,2-dimethyl-5-[(2R)-2-methyl-1-aziridinyl]indole-4,7-dione IUPAC Name: 3-(hydroxymethyl)-1,2-dimethyl-5-[(2R)-2-methylaziridin-1-yl]indole-4,7-dione Traditional Name: 1,2-dimethyl-5-[(2R)-2-methylethylenimin-1-yl]-3-methylol-indole-4,7-quinone Formula: C14H16N2O3 MolecularWeight: 260.28844

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

C[C@@H]1CN1C2=CC(=O)C3=C(C2=O)C(=C(N3C)C)CO

InChI

InChI=1S/C14H16N2O3/c1-7-5-16(7)10-4-11(18)13-12(14(10)19)9(6-17)8(2)15(13)3/h4,7,17H,5-6H2,1-3H3/t7-,16?/m1/s1