4-[4-[bis(2-chloroethyl)amino]phenyl]imino-3-methyl-cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[4-[bis(2-chloroethyl)amino]phenyl]imino-3-methyl-cyclohexa-2,5-dien-1-one Openeye Name: 4-[4-[bis(2-chloroethyl)amino]phenyl]imino-3-methyl-cyclohexa-2,5-dien-1-one CAS Name: 4-[4-[bis(2-chloroethyl)amino]phenyl]imino-3-methyl-1-cyclohexa-2,5-dienone IUPAC Name: 4-[4-[bis(2-chloroethyl)amino]phenyl]imino-3-methylcyclohexa-2,5-dien-1-one Traditional Name: 4-[4-[bis(2-chloroethyl)amino]phenyl]imino-3-methyl-cyclohexa-2,5-dien-1-one Formula: C17H18Cl2N2O MolecularWeight: 337.24362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C=CC1=NC2=CC=C(C=C2)N(CCCl)CCCl

Isomeric SMILES

CC1=CC(=O)C=CC1=NC2=CC=C(C=C2)N(CCCl)CCCl

InChI

InChI=1S/C17H18Cl2N2O/c1-13-12-16(22)6-7-17(13)20-14-2-4-15(5-3-14)21(10-8-18)11-9-19/h2-7,12H,8-11H2,1H3