tert-butyl 4-[4-[(2,6-dimethoxy-4-methyl-phenyl)methylamino]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[(2,6-dimethoxy-4-methyl-phenyl)methylamino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[(2,6-dimethoxy-4-methyl-phenyl)methylamino]phenyl]piperazine-1-carboxylate CAS Name: 4-[4-[(2,6-dimethoxy-4-methylphenyl)methylamino]phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[(2,6-dimethoxy-4-methylphenyl)methylamino]phenyl]piperazine-1-carboxylate Traditional Name: 4-[4-[(2,6-dimethoxy-4-methyl-benzyl)amino]phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H35N3O4 MolecularWeight: 441.5631

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC)CNC2=CC=C(C=C2)N3CCN(CC3)C(=O)OC(C)(C)C)OC

Isomeric SMILES

CC1=CC(=C(C(=C1)OC)CNC2=CC=C(C=C2)N3CCN(CC3)C(=O)OC(C)(C)C)OC

InChI

InChI=1S/C25H35N3O4/c1-18-15-22(30-5)21(23(16-18)31-6)17-26-19-7-9-20(10-8-19)27-11-13-28(14-12-27)24(29)32-25(2,3)4/h7-10,15-16,26H,11-14,17H2,1-6H3