tert-butyl N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxo-propyl]carbamate CAS Name: N-[3-[4-(2,3-dimethylphenyl)-1-piperazinyl]-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]-3-oxopropyl]carbamate Traditional Name: N-[3-[4-(2,3-dimethylphenyl)piperazino]-3-keto-propyl]carbamic acid tert-butyl ester Formula: C20H31N3O3 MolecularWeight: 361.47844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCNC(=O)OC(C)(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)CCNC(=O)OC(C)(C)C)C

InChI

InChI=1S/C20H31N3O3/c1-15-7-6-8-17(16(15)2)22-11-13-23(14-12-22)18(24)9-10-21-19(25)26-20(3,4)5/h6-8H,9-14H2,1-5H3,(H,21,25)