tert-butyl 4-[3-[(2-azanyl-4-methoxycarbonyl-phenyl)amino]phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[3-[(2-azanyl-4-methoxycarbonyl-phenyl)amino]phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[3-(2-amino-4-methoxycarbonyl-anilino)phenyl]piperazine-1-carboxylate CAS Name: 4-[3-(2-amino-4-methoxycarbonylanilino)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[3-(2-amino-4-methoxycarbonylanilino)phenyl]piperazine-1-carboxylate Traditional Name: 4-[3-(2-amino-4-carbomethoxy-anilino)phenyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C23H30N4O4 MolecularWeight: 426.5087

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OC)N

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=CC(=CC=C2)NC3=C(C=C(C=C3)C(=O)OC)N

InChI

InChI=1S/C23H30N4O4/c1-23(2,3)31-22(29)27-12-10-26(11-13-27)18-7-5-6-17(15-18)25-20-9-8-16(14-19(20)24)21(28)30-4/h5-9,14-15,25H,10-13,24H2,1-4H3