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

Systemtic Name: (phenylmethyl) N-chloranyl-N-[4-methyl-1-(1-oxidanylhexan-2-ylamino)-1-oxidanylidene-pentan-2-yl]carbamate Openeye Name: benzyl N-chloro-N-[1-[1-(hydroxymethyl)pentylcarbamoyl]-3-methyl-butyl]carbamate CAS Name: N-chloro-N-[1-(1-hydroxyhexan-2-ylamino)-4-methyl-1-oxopentan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-chloro-N-[1-(1-hydroxyhexan-2-ylamino)-4-methyl-1-oxopentan-2-yl]carbamate Traditional Name: N-chloro-N-[3-methyl-1-(1-methylolpentylcarbamoyl)butyl]carbamic acid benzyl ester Formula: C20H31ClN2O4 MolecularWeight: 398.92414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H31ClN2O4/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/h6-10,15,17-18,24H,4-5,11-14H2,1-3H3,(H,22,25)