tert-butyl N-[3-[3-(4-phenylpiperazin-1-yl)propylcarbamoyl]phenyl]carbamate

Systemtic Name: tert-butyl N-[3-[3-(4-phenylpiperazin-1-yl)propylcarbamoyl]phenyl]carbamate Openeye Name: tert-butyl N-[3-[3-(4-phenylpiperazin-1-yl)propylcarbamoyl]phenyl]carbamate CAS Name: N-[3-[oxo-[3-(4-phenyl-1-piperazinyl)propylamino]methyl]phenyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[3-(4-phenylpiperazin-1-yl)propylcarbamoyl]phenyl]carbamate Traditional Name: N-[3-[3-(4-phenylpiperazino)propylcarbamoyl]phenyl]carbamic acid tert-butyl ester Formula: C25H34N4O3 MolecularWeight: 438.56246

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)OC(=O)NC1=CC=CC(=C1)C(=O)NCCCN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C25H34N4O3/c1-25(2,3)32-24(31)27-21-10-7-9-20(19-21)23(30)26-13-8-14-28-15-17-29(18-16-28)22-11-5-4-6-12-22/h4-7,9-12,19H,8,13-18H2,1-3H3,(H,26,30)(H,27,31)