tert-butyl N-methyl-N-[(1S,3R)-3-[4-(phenylmethyl)piperazin-1-yl]cyclopentyl]carbamate

Systemtic Name: tert-butyl N-methyl-N-[(1S,3R)-3-[4-(phenylmethyl)piperazin-1-yl]cyclopentyl]carbamate Openeye Name: tert-butyl N-[(1S,3R)-3-(4-benzylpiperazin-1-yl)cyclopentyl]-N-methyl-carbamate CAS Name: N-methyl-N-[(1S,3R)-3-[4-(phenylmethyl)-1-piperazinyl]cyclopentyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(1S,3R)-3-(4-benzylpiperazin-1-yl)cyclopentyl]-N-methylcarbamate Traditional Name: N-[(1S,3R)-3-(4-benzylpiperazino)cyclopentyl]-N-methyl-carbamic acid tert-butyl ester Formula: C22H35N3O2 MolecularWeight: 373.5322

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N(C)C1CCC(C1)N2CCN(CC2)CC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)N(C)[C@H]1CC[C@H](C1)N2CCN(CC2)CC3=CC=CC=C3

InChI

InChI=1S/C22H35N3O2/c1-22(2,3)27-21(26)23(4)19-10-11-20(16-19)25-14-12-24(13-15-25)17-18-8-6-5-7-9-18/h5-9,19-20H,10-17H2,1-4H3/t19-,20+/m0/s1