tert-butyl N-[3-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-(4-chlorophenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[4-(4-chlorobenzoyl)piperazin-1-yl]-3-oxo-propyl]carbamate CAS Name: N-[3-[4-[(4-chlorophenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(4-chlorobenzoyl)piperazin-1-yl]-3-oxopropyl]carbamate Traditional Name: N-[3-[4-(4-chlorobenzoyl)piperazino]-3-keto-propyl]carbamic acid tert-butyl ester Formula: C19H26ClN3O4 MolecularWeight: 395.88044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)(C)OC(=O)NCCC(=O)N1CCN(CC1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C19H26ClN3O4/c1-19(2,3)27-18(26)21-9-8-16(24)22-10-12-23(13-11-22)17(25)14-4-6-15(20)7-5-14/h4-7H,8-13H2,1-3H3,(H,21,26)