ethyl 1-[4-[(4-chlorophenyl)diazenyl]phenyl]-3-(4-dimethylaminophenyl)-2-ethanoyl-aziridine-2-carboxylate

Systemtic Name: ethyl 1-[4-[(4-chlorophenyl)diazenyl]phenyl]-3-(4-dimethylaminophenyl)-2-ethanoyl-aziridine-2-carboxylate Openeye Name: ethyl 2-acetyl-1-[4-(4-chlorophenyl)azophenyl]-3-(4-dimethylaminophenyl)aziridine-2-carboxylate CAS Name: 2-acetyl-1-[4-(4-chlorophenyl)azophenyl]-3-(4-dimethylaminophenyl)-2-aziridinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-acetyl-1-[4-[(4-chlorophenyl)diazenyl]phenyl]-3-(4-dimethylaminophenyl)aziridine-2-carboxylate Traditional Name: 2-acetyl-1-[4-(4-chlorophenyl)azophenyl]-3-(4-dimethylaminophenyl)ethylenimine-2-carboxylic acid ethyl ester Formula: C27H27ClN4O3 MolecularWeight: 490.98128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(C(N1C2=CC=C(C=C2)N=NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)C)C(=O)C

Isomeric SMILES

CCOC(=O)C1(C(N1C2=CC=C(C=C2)N=NC3=CC=C(C=C3)Cl)C4=CC=C(C=C4)N(C)C)C(=O)C

InChI

InChI=1S/C27H27ClN4O3/c1-5-35-26(34)27(18(2)33)25(19-6-14-23(15-7-19)31(3)4)32(27)24-16-12-22(13-17-24)30-29-21-10-8-20(28)9-11-21/h6-17,25H,5H2,1-4H3