tert-butyl N-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]carbamate

Systemtic Name: tert-butyl N-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxidanylidene-butyl]carbamate Openeye Name: tert-butyl N-[4-[4-(o-tolylmethyl)piperazin-1-yl]-4-oxo-butyl]carbamate CAS Name: N-[4-[4-[(2-methylphenyl)methyl]-1-piperazinyl]-4-oxobutyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[4-[4-[(2-methylphenyl)methyl]piperazin-1-yl]-4-oxobutyl]carbamate Traditional Name: N-[4-keto-4-[4-(2-methylbenzyl)piperazino]butyl]carbamic acid tert-butyl ester Formula: C21H33N3O3 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCCNC(=O)OC(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)CCCNC(=O)OC(C)(C)C

InChI

InChI=1S/C21H33N3O3/c1-17-8-5-6-9-18(17)16-23-12-14-24(15-13-23)19(25)10-7-11-22-20(26)27-21(2,3)4/h5-6,8-9H,7,10-16H2,1-4H3,(H,22,26)