(phenylmethyl) N-chloranyl-N-[4-methyl-1-oxidanylidene-1-(1-oxidanylidenehexan-2-ylamino)pentan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-chloranyl-N-[4-methyl-1-oxidanylidene-1-(1-oxidanylidenehexan-2-ylamino)pentan-2-yl]carbamate Openeye Name: benzyl N-chloro-N-[1-(1-formylpentylcarbamoyl)-3-methyl-butyl]carbamate CAS Name: N-chloro-N-[4-methyl-1-oxo-1-(1-oxohexan-2-ylamino)pentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-chloro-N-[4-methyl-1-oxo-1-(1-oxohexan-2-ylamino)pentan-2-yl]carbamate Traditional Name: N-chloro-N-[1-(1-formylpentylcarbamoyl)-3-methyl-butyl]carbamic acid benzyl ester Formula: C20H29ClN2O4 MolecularWeight: 396.90826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C=O)NC(=O)C(CC(C)C)N(C(=O)OCC1=CC=CC=C1)Cl

Isomeric SMILES

CCCCC(C=O)NC(=O)C(CC(C)C)N(C(=O)OCC1=CC=CC=C1)Cl

InChI

InChI=1S/C20H29ClN2O4/c1-4-5-11-17(13-24)22-19(25)18(12-15(2)3)23(21)20(26)27-14-16-9-7-6-8-10-16/h6-10,13,15,17-18H,4-5,11-12,14H2,1-3H3,(H,22,25)