methyl 6-(2-dodecanoyl-2-propyl-hydrazinyl)-6-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]carbonylamino]hexanoate

Systemtic Name: methyl 6-(2-dodecanoyl-2-propyl-hydrazinyl)-6-oxidanylidene-5-[[1-(phenylmethyl)indol-3-yl]carbonylamino]hexanoate Openeye Name: methyl 5-[(1-benzylindole-3-carbonyl)amino]-6-(2-dodecanoyl-2-propyl-hydrazino)-6-oxo-hexanoate CAS Name: 6-oxo-6-[2-(1-oxododecyl)-2-propylhydrazinyl]-5-[[oxo-[1-(phenylmethyl)-3-indolyl]methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 5-[(1-benzylindole-3-carbonyl)amino]-6-(2-dodecanoyl-2-propylhydrazinyl)-6-oxohexanoate Traditional Name: 5-[(1-benzylindole-3-carbonyl)amino]-6-keto-6-(N'-lauroyl-N'-propyl-hydrazino)hexanoic acid methyl ester Formula: C38H54N4O5 MolecularWeight: 646.85916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC(=O)N(CCC)NC(=O)C(CCCC(=O)OC)NC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCC(=O)N(CCC)NC(=O)C(CCCC(=O)OC)NC(=O)C1=CN(C2=CC=CC=C21)CC3=CC=CC=C3

InChI

InChI=1S/C38H54N4O5/c1-4-6-7-8-9-10-11-12-16-25-35(43)42(27-5-2)40-38(46)33(23-19-26-36(44)47-3)39-37(45)32-29-41(28-30-20-14-13-15-21-30)34-24-18-17-22-31(32)34/h13-15,17-18,20-22,24,29,33H,4-12,16,19,23,25-28H2,1-3H3,(H,39,45)(H,40,46)