3-[bis(2-chloroethyl)aminomethyl]-6-methoxy-1,8-bis(oxidanyl)anthracene-9,10-dione

Systemtic Name: 3-[bis(2-chloroethyl)aminomethyl]-6-methoxy-1,8-bis(oxidanyl)anthracene-9,10-dione Openeye Name: 3-[bis(2-chloroethyl)aminomethyl]-1,8-dihydroxy-6-methoxy-anthracene-9,10-dione CAS Name: 3-[bis(2-chloroethyl)aminomethyl]-1,8-dihydroxy-6-methoxyanthracene-9,10-dione IUPAC Name: 3-[bis(2-chloroethyl)aminomethyl]-1,8-dihydroxy-6-methoxyanthracene-9,10-dione Traditional Name: 3-[bis(2-chloroethyl)aminomethyl]-1,8-dihydroxy-6-methoxy-9,10-anthraquinone Formula: C20H19Cl2NO5 MolecularWeight: 424.27456

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)CN(CCCl)CCCl)O

Isomeric SMILES

COC1=CC(=C2C(=C1)C(=O)C3=CC(=CC(=C3C2=O)O)CN(CCCl)CCCl)O

InChI

InChI=1S/C20H19Cl2NO5/c1-28-12-8-14-18(16(25)9-12)20(27)17-13(19(14)26)6-11(7-15(17)24)10-23(4-2-21)5-3-22/h6-9,24-25H,2-5,10H2,1H3