5-(aziridin-1-yl)-3-(hydroxymethyl)-1-methyl-2-(1-oxidanylprop-2-enyl)indole-4,7-dione

Systemtic Name: 5-(aziridin-1-yl)-3-(hydroxymethyl)-1-methyl-2-(1-oxidanylprop-2-enyl)indole-4,7-dione Openeye Name: 5-(aziridin-1-yl)-2-(1-hydroxyallyl)-3-(hydroxymethyl)-1-methyl-indole-4,7-dione CAS Name: 5-(1-aziridinyl)-3-(hydroxymethyl)-2-(1-hydroxyprop-2-enyl)-1-methylindole-4,7-dione IUPAC Name: 5-(aziridin-1-yl)-3-(hydroxymethyl)-2-(1-hydroxyprop-2-enyl)-1-methylindole-4,7-dione Traditional Name: 5-ethylenimino-2-(1-hydroxyallyl)-1-methyl-3-methylol-indole-4,7-quinone Formula: C15H16N2O4 MolecularWeight: 288.29854

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=C1C(C=C)O)CO)C(=O)C(=CC2=O)N3CC3

Isomeric SMILES

CN1C2=C(C(=C1C(C=C)O)CO)C(=O)C(=CC2=O)N3CC3

InChI

InChI=1S/C15H16N2O4/c1-3-10(19)13-8(7-18)12-14(16(13)2)11(20)6-9(15(12)21)17-4-5-17/h3,6,10,18-19H,1,4-5,7H2,2H3