2-[bis(2-chloroethyl)amino]-6-phenyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-[bis(2-chloroethyl)amino]-6-phenyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-[bis(2-chloroethyl)amino]-6-phenyl-1,4-benzoquinone CAS Name: 2-[bis(2-chloroethyl)amino]-6-phenylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-[bis(2-chloroethyl)amino]-6-phenylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-[bis(2-chloroethyl)amino]-6-phenyl-p-benzoquinone Formula: C16H15Cl2NO2 MolecularWeight: 324.2018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=O)C=C(C2=O)N(CCCl)CCCl

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=O)C=C(C2=O)N(CCCl)CCCl

InChI

InChI=1S/C16H15Cl2NO2/c17-6-8-19(9-7-18)15-11-13(20)10-14(16(15)21)12-4-2-1-3-5-12/h1-5,10-11H,6-9H2