tert-butyl 4-[4-[bis(2-azidoethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[4-[bis(2-azidoethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[4-[bis(2-azidoethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]piperazine-1-carboxylate CAS Name: 4-[4-[bis(2-azidoethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[4-[bis(2-azidoethyl)amino]-6-methoxy-1,3,5-triazin-2-yl]piperazine-1-carboxylate Traditional Name: 4-[4-[bis(2-azidoethyl)amino]-6-methoxy-s-triazin-2-yl]piperazine-1-carboxylic acid tert-butyl ester Formula: C17H28N12O3 MolecularWeight: 448.48282

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=N2)OC)N(CCN=[N+]=[N-])CCN=[N+]=[N-]

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)C2=NC(=NC(=N2)OC)N(CCN=[N+]=[N-])CCN=[N+]=[N-]

InChI

InChI=1S/C17H28N12O3/c1-17(2,3)32-16(30)29-11-9-28(10-12-29)14-22-13(23-15(24-14)31-4)27(7-5-20-25-18)8-6-21-26-19/h5-12H2,1-4H3