tert-butyl N-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4-oxo-butyl]carbamate CAS Name: N-[4-[4-[(3,4-dimethoxyphenyl)methyl]-1-piperazinyl]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-[(3,4-dimethoxyphenyl)methyl]piperazin-1-yl]-4-oxobutyl]carbamate Traditional Name: N-[4-keto-4-(4-veratrylpiperazino)butyl]carbamic acid tert-butyl ester Formula: C22H35N3O5 MolecularWeight: 421.5304

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCCCC(=O)N1CCN(CC1)CC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C)OC(=O)NCCCC(=O)N1CCN(CC1)CC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C22H35N3O5/c1-22(2,3)30-21(27)23-10-6-7-20(26)25-13-11-24(12-14-25)16-17-8-9-18(28-4)19(15-17)29-5/h8-9,15H,6-7,10-14,16H2,1-5H3,(H,23,27)