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

Systemtic Name: tert-butyl N-[3-[4-(3-methoxyphenyl)carbonylpiperazin-1-yl]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[4-(3-methoxybenzoyl)piperazin-1-yl]-3-oxo-propyl]carbamate CAS Name: N-[3-[4-[(3-methoxyphenyl)-oxomethyl]-1-piperazinyl]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(3-methoxybenzoyl)piperazin-1-yl]-3-oxopropyl]carbamate Traditional Name: N-[3-keto-3-(4-m-anisoylpiperazino)propyl]carbamic acid tert-butyl ester Formula: C20H29N3O5 MolecularWeight: 391.46136

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H29N3O5/c1-20(2,3)28-19(26)21-9-8-17(24)22-10-12-23(13-11-22)18(25)15-6-5-7-16(14-15)27-4/h5-7,14H,8-13H2,1-4H3,(H,21,26)