tert-butyl N-[(Z)-4-[2-[(6-aminopurin-9-yl)methoxy]ethyl-methyl-amino]but-2-enyl]carbamate

Systemtic Name: tert-butyl N-[(Z)-4-[2-[(6-aminopurin-9-yl)methoxy]ethyl-methyl-amino]but-2-enyl]carbamate Openeye Name: tert-butyl N-[(Z)-4-[2-[(6-aminopurin-9-yl)methoxy]ethyl-methyl-amino]but-2-enyl]carbamate CAS Name: N-[(Z)-4-[2-[(6-aminopurin-9-yl)methoxy]ethyl-methylamino]but-2-enyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(Z)-4-[2-[(6-aminopurin-9-yl)methoxy]ethyl-methylamino]but-2-enyl]carbamate Traditional Name: N-[(Z)-4-[2-(adenin-9-ylmethoxy)ethyl-methyl-amino]but-2-enyl]carbamic acid tert-butyl ester Formula: C18H29N7O3 MolecularWeight: 391.46796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC=CCN(C)CCOCN1C=NC2=C1N=CN=C2N

Isomeric SMILES

CC(C)(C)OC(=O)NC/C=C\CN(C)CCOCN1C=NC2=C1N=CN=C2N

InChI

InChI=1S/C18H29N7O3/c1-18(2,3)28-17(26)20-7-5-6-8-24(4)9-10-27-13-25-12-23-14-15(19)21-11-22-16(14)25/h5-6,11-12H,7-10,13H2,1-4H3,(H,20,26)(H2,19,21,22)/b6-5-