(phenylmethyl) N-[5-methyl-1-[[1-(octylamino)-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-3-yl]carbamate

Systemtic Name: (phenylmethyl) N-[5-methyl-1-[[1-(octylamino)-1-oxidanylidene-butan-2-yl]amino]-1-oxidanylidene-hexan-3-yl]carbamate Openeye Name: benzyl N-[3-methyl-1-[2-[1-(octylcarbamoyl)propylamino]-2-oxo-ethyl]butyl]carbamate CAS Name: N-[5-methyl-1-[[1-(octylamino)-1-oxobutan-2-yl]amino]-1-oxohexan-3-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[5-methyl-1-[[1-(octylamino)-1-oxobutan-2-yl]amino]-1-oxohexan-3-yl]carbamate Traditional Name: N-[1-[2-keto-2-[1-(octylcarbamoyl)propylamino]ethyl]-3-methyl-butyl]carbamic acid benzyl ester Formula: C27H45N3O4 MolecularWeight: 475.6639

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=O)C(CC)NC(=O)CC(CC(C)C)NC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CCCCCCCCNC(=O)C(CC)NC(=O)CC(CC(C)C)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C27H45N3O4/c1-5-7-8-9-10-14-17-28-26(32)24(6-2)30-25(31)19-23(18-21(3)4)29-27(33)34-20-22-15-12-11-13-16-22/h11-13,15-16,21,23-24H,5-10,14,17-20H2,1-4H3,(H,28,32)(H,29,33)(H,30,31)