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

Systemtic Name: 5-(aziridin-1-ylmethyl)-3-(hydroxymethyl)-1-methyl-2-phenyl-indole-4,7-dione Openeye Name: 5-(aziridin-1-ylmethyl)-3-(hydroxymethyl)-1-methyl-2-phenyl-indole-4,7-dione CAS Name: 5-(1-aziridinylmethyl)-3-(hydroxymethyl)-1-methyl-2-phenylindole-4,7-dione IUPAC Name: 5-(aziridin-1-ylmethyl)-3-(hydroxymethyl)-1-methyl-2-phenylindole-4,7-dione Traditional Name: 5-(ethyleniminomethyl)-1-methyl-3-methylol-2-phenyl-indole-4,7-quinone Formula: C19H18N2O3 MolecularWeight: 322.35782

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C2=C1C(=O)C=C(C2=O)CN3CC3)CO)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C2=C1C(=O)C=C(C2=O)CN3CC3)CO)C4=CC=CC=C4

InChI

InChI=1S/C19H18N2O3/c1-20-17(12-5-3-2-4-6-12)14(11-22)16-18(20)15(23)9-13(19(16)24)10-21-7-8-21/h2-6,9,22H,7-8,10-11H2,1H3