tert-butyl 4-[benzotriazol-1-yl(phenyl)methyl]-3-methyl-piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[benzotriazol-1-yl(phenyl)methyl]-3-methyl-piperazine-1-carboxylate Openeye Name: tert-butyl 4-[benzotriazol-1-yl(phenyl)methyl]-3-methyl-piperazine-1-carboxylate CAS Name: 4-[1-benzotriazolyl(phenyl)methyl]-3-methyl-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[benzotriazol-1-yl(phenyl)methyl]-3-methylpiperazine-1-carboxylate Traditional Name: 4-[benzotriazol-1-yl(phenyl)methyl]-3-methyl-piperazine-1-carboxylic acid tert-butyl ester Formula: C23H29N5O2 MolecularWeight: 407.50866

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1CN(CCN1C(C2=CC=CC=C2)N3C4=CC=CC=C4N=N3)C(=O)OC(C)(C)C

InChI

InChI=1S/C23H29N5O2/c1-17-16-26(22(29)30-23(2,3)4)14-15-27(17)21(18-10-6-5-7-11-18)28-20-13-9-8-12-19(20)24-25-28/h5-13,17,21H,14-16H2,1-4H3