methyl N-(2-methylbutyl)-N-[[(E)-3-(oxidanylcarbamoyl)-4-phenyl-but-3-enyl]-pentanoyl-amino]carbamate

Systemtic Name: methyl N-(2-methylbutyl)-N-[[(E)-3-(oxidanylcarbamoyl)-4-phenyl-but-3-enyl]-pentanoyl-amino]carbamate Openeye Name: methyl N-[[(E)-3-(hydroxycarbamoyl)-4-phenyl-but-3-enyl]-pentanoyl-amino]-N-(2-methylbutyl)carbamate CAS Name: N-[[(E)-3-[(hydroxyamino)-oxomethyl]-4-phenylbut-3-enyl]-(1-oxopentyl)amino]-N-(2-methylbutyl)carbamic acid methyl ester IUPAC Name: methyl N-[[(E)-3-(hydroxycarbamoyl)-4-phenylbut-3-enyl]-pentanoylamino]-N-(2-methylbutyl)carbamate Traditional Name: N-[[(E)-3-(hydroxycarbamoyl)-4-phenyl-but-3-enyl]-valeryl-amino]-N-(2-methylbutyl)carbamic acid methyl ester Formula: C23H35N3O5 MolecularWeight: 433.5411

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N(CCC(=CC1=CC=CC=C1)C(=O)NO)N(CC(C)CC)C(=O)OC

Isomeric SMILES

CCCCC(=O)N(CC/C(=C\C1=CC=CC=C1)/C(=O)NO)N(CC(C)CC)C(=O)OC

InChI

InChI=1S/C23H35N3O5/c1-5-7-13-21(27)25(26(23(29)31-4)17-18(3)6-2)15-14-20(22(28)24-30)16-19-11-9-8-10-12-19/h8-12,16,18,30H,5-7,13-15,17H2,1-4H3,(H,24,28)/b20-16+