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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC=C(C1=C(C2=C(N1C)C(=O)C=C(C2=O)N3CC3)CO)O

Isomeric SMILES

C/C=C(/C1=C(C2=C(N1C)C(=O)C=C(C2=O)N3CC3)CO)\O

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/h3,6,18-19H,4-5,7H2,1-2H3/b10-3-