6-chloranyl-7-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-5,8-bis(oxidanyl)naphthalene-1,4-dione

Systemtic Name: 6-chloranyl-7-[(2-methyl-1-oxidanyl-propan-2-yl)amino]-5,8-bis(oxidanyl)naphthalene-1,4-dione Openeye Name: 6-chloro-5,8-dihydroxy-7-[(2-hydroxy-1,1-dimethyl-ethyl)amino]naphthalene-1,4-dione CAS Name: 6-chloro-5,8-dihydroxy-7-[(1-hydroxy-2-methylpropan-2-yl)amino]naphthalene-1,4-dione IUPAC Name: 6-chloro-5,8-dihydroxy-7-[(1-hydroxy-2-methylpropan-2-yl)amino]naphthalene-1,4-dione Traditional Name: 6-chloro-5,8-dihydroxy-7-[(2-hydroxy-1,1-dimethyl-ethyl)amino]-1,4-naphthoquinone Formula: C14H14ClNO5 MolecularWeight: 311.71766

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)NC1=C(C2=C(C(=O)C=CC2=O)C(=C1Cl)O)O

Isomeric SMILES

CC(C)(CO)NC1=C(C2=C(C(=O)C=CC2=O)C(=C1Cl)O)O

InChI

InChI=1S/C14H14ClNO5/c1-14(2,5-17)16-11-10(15)12(20)8-6(18)3-4-7(19)9(8)13(11)21/h3-4,16-17,20-21H,5H2,1-2H3