3-[bis(2-chloroethyl)aminomethyl]-1,2-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 3-[bis(2-chloroethyl)aminomethyl]-1,2-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 3-[bis(2-chloroethyl)aminomethyl]-1,2-dihydroxy-anthracene-9,10-dione CAS Name: 3-[bis(2-chloroethyl)aminomethyl]-1,2-dihydroxyanthracene-9,10-dione IUPAC Name: 3-[bis(2-chloroethyl)aminomethyl]-1,2-dihydroxyanthracene-9,10-dione Traditional Name: 3-[bis(2-chloroethyl)aminomethyl]-1,2-dihydroxy-9,10-anthraquinone Formula: C19H17Cl2NO4 MolecularWeight: 394.24858

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CCCl)CCCl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=CC(=C(C(=C3C2=O)O)O)CN(CCCl)CCCl

InChI

InChI=1S/C19H17Cl2NO4/c20-5-7-22(8-6-21)10-11-9-14-15(19(26)16(11)23)18(25)13-4-2-1-3-12(13)17(14)24/h1-4,9,23,26H,5-8,10H2