(phenylmethyl) 6-[2-[4-(4-butylphenyl)butanoyl]-2-propyl-hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate

Systemtic Name: (phenylmethyl) 6-[2-[4-(4-butylphenyl)butanoyl]-2-propyl-hydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxidanylidene-hexanoate Openeye Name: benzyl 5-(tert-butoxycarbonylamino)-6-[2-[4-(4-butylphenyl)butanoyl]-2-propyl-hydrazino]-6-oxo-hexanoate CAS Name: 6-[2-[4-(4-butylphenyl)-1-oxobutyl]-2-propylhydrazinyl]-5-[[(2-methylpropan-2-yl)oxy-oxomethyl]amino]-6-oxohexanoic acid (phenylmethyl) ester IUPAC Name: benzyl 6-[2-[4-(4-butylphenyl)butanoyl]-2-propylhydrazinyl]-5-[(2-methylpropan-2-yl)oxycarbonylamino]-6-oxohexanoate Traditional Name: 5-(tert-butoxycarbonylamino)-6-[N'-[4-(4-butylphenyl)butanoyl]-N'-propyl-hydrazino]-6-keto-hexanoic acid benzyl ester Formula: C35H51N3O6 MolecularWeight: 609.79594

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CCCC(=O)N(CCC)NC(=O)C(CCCC(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)CCCC(=O)N(CCC)NC(=O)C(CCCC(=O)OCC2=CC=CC=C2)NC(=O)OC(C)(C)C

InChI

InChI=1S/C35H51N3O6/c1-6-8-14-27-21-23-28(24-22-27)17-12-19-31(39)38(25-7-2)37-33(41)30(36-34(42)44-35(3,4)5)18-13-20-32(40)43-26-29-15-10-9-11-16-29/h9-11,15-16,21-24,30H,6-8,12-14,17-20,25-26H2,1-5H3,(H,36,42)(H,37,41)