ethyl N-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylphenyl]carbamate

Systemtic Name: ethyl N-[3-[4-(5-chloranyl-2-methyl-phenyl)piperazin-1-yl]carbonylphenyl]carbamate Openeye Name: ethyl N-[3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]phenyl]carbamate CAS Name: N-[3-[[4-(5-chloro-2-methylphenyl)-1-piperazinyl]-oxomethyl]phenyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[3-[4-(5-chloro-2-methylphenyl)piperazine-1-carbonyl]phenyl]carbamate Traditional Name: N-[3-[4-(5-chloro-2-methyl-phenyl)piperazine-1-carbonyl]phenyl]carbamic acid ethyl ester Formula: C21H24ClN3O3 MolecularWeight: 401.88656

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

Isomeric SMILES

CCOC(=O)NC1=CC=CC(=C1)C(=O)N2CCN(CC2)C3=C(C=CC(=C3)Cl)C

InChI

InChI=1S/C21H24ClN3O3/c1-3-28-21(27)23-18-6-4-5-16(13-18)20(26)25-11-9-24(10-12-25)19-14-17(22)8-7-15(19)2/h4-8,13-14H,3,9-12H2,1-2H3,(H,23,27)