ethyl N-[6-(4-chlorophenyl)carbonyl-1H-perimidin-2-yl]carbamate

Systemtic Name: ethyl N-[6-(4-chlorophenyl)carbonyl-1H-perimidin-2-yl]carbamate Openeye Name: ethyl N-[6-(4-chlorobenzoyl)-1H-perimidin-2-yl]carbamate CAS Name: N-[6-[(4-chlorophenyl)-oxomethyl]-1H-perimidin-2-yl]carbamic acid ethyl ester IUPAC Name: ethyl N-[6-(4-chlorobenzoyl)-1H-perimidin-2-yl]carbamate Traditional Name: N-[6-(4-chlorobenzoyl)-1H-perimidin-2-yl]carbamic acid ethyl ester Formula: C21H16ClN3O3 MolecularWeight: 393.82304

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=NC2=C3C(=C(C=C2)C(=O)C4=CC=C(C=C4)Cl)C=CC=C3N1

Isomeric SMILES

CCOC(=O)NC1=NC2=C3C(=C(C=C2)C(=O)C4=CC=C(C=C4)Cl)C=CC=C3N1

InChI

InChI=1S/C21H16ClN3O3/c1-2-28-21(27)25-20-23-16-5-3-4-14-15(10-11-17(24-20)18(14)16)19(26)12-6-8-13(22)9-7-12/h3-11H,2H2,1H3,(H2,23,24,25,27)