tert-butyl N-[N'-(1-adamantylmethyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]-N-hex-5-enyl-carbamate

Systemtic Name: tert-butyl N-[N'-(1-adamantylmethyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]-N-hex-5-enyl-carbamate Openeye Name: tert-butyl N-[N'-(1-adamantylmethyl)-N-tert-butoxycarbonyl-carbamimidoyl]-N-hex-5-enyl-carbamate CAS Name: N-[1-adamantylmethylimino-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]methyl]-N-hex-5-enylcarbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[N'-(1-adamantylmethyl)-N-[(2-methylpropan-2-yl)oxycarbonyl]carbamimidoyl]-N-hex-5-enylcarbamate Traditional Name: N-[N'-(1-adamantylmethyl)-N-tert-butoxycarbonyl-amidino]-N-hex-5-enyl-carbamic acid tert-butyl ester Formula: C28H47N3O4 MolecularWeight: 489.69048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC(=NCC12CC3CC(C1)CC(C3)C2)N(CCCCC=C)C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)OC(=O)NC(=NCC12CC3CC(C1)CC(C3)C2)N(CCCCC=C)C(=O)OC(C)(C)C

InChI

InChI=1S/C28H47N3O4/c1-8-9-10-11-12-31(25(33)35-27(5,6)7)23(30-24(32)34-26(2,3)4)29-19-28-16-20-13-21(17-28)15-22(14-20)18-28/h8,20-22H,1,9-19H2,2-7H3,(H,29,30,32)