(phenylmethyl) N-[3-methyl-1-oxidanylidene-1-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[3-methyl-1-oxidanylidene-1-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-2-yl]carbamate Openeye Name: benzyl N-[2-methyl-1-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)propyl]carbamate CAS Name: N-[3-methyl-1-oxo-1-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[3-methyl-1-oxo-1-(1,4,7-trioxa-10-azacyclododec-10-yl)butan-2-yl]carbamate Traditional Name: N-[2-methyl-1-(1,4,7-trioxa-10-azacyclododecane-10-carbonyl)propyl]carbamic acid benzyl ester Formula: C21H32N2O6 MolecularWeight: 408.48858

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)N1CCOCCOCCOCC1)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)C(C(=O)N1CCOCCOCCOCC1)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C21H32N2O6/c1-17(2)19(22-21(25)29-16-18-6-4-3-5-7-18)20(24)23-8-10-26-12-14-28-15-13-27-11-9-23/h3-7,17,19H,8-16H2,1-2H3,(H,22,25)