methyl 6-[2-butyl-2-[4-(4-heptylphenyl)butanoyl]hydrazinyl]-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoate

Systemtic Name: methyl 6-[2-butyl-2-[4-(4-heptylphenyl)butanoyl]hydrazinyl]-6-oxidanylidene-5-(quinolin-2-ylcarbonylamino)hexanoate Openeye Name: methyl 6-[2-butyl-2-[4-(4-heptylphenyl)butanoyl]hydrazino]-6-oxo-5-(quinoline-2-carbonylamino)hexanoate CAS Name: 6-[2-butyl-2-[4-(4-heptylphenyl)-1-oxobutyl]hydrazinyl]-6-oxo-5-[[oxo(2-quinolinyl)methyl]amino]hexanoic acid methyl ester IUPAC Name: methyl 6-[2-butyl-2-[4-(4-heptylphenyl)butanoyl]hydrazinyl]-6-oxo-5-(quinoline-2-carbonylamino)hexanoate Traditional Name: 6-[N'-butyl-N'-[4-(4-heptylphenyl)butanoyl]hydrazino]-6-keto-5-(quinaldoylamino)hexanoic acid methyl ester Formula: C38H52N4O5 MolecularWeight: 644.84328

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)CCCC(=O)N(CCCC)NC(=O)C(CCCC(=O)OC)NC(=O)C2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)CCCC(=O)N(CCCC)NC(=O)C(CCCC(=O)OC)NC(=O)C2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C38H52N4O5/c1-4-6-8-9-10-15-29-22-24-30(25-23-29)16-13-20-35(43)42(28-7-5-2)41-38(46)33(19-14-21-36(44)47-3)40-37(45)34-27-26-31-17-11-12-18-32(31)39-34/h11-12,17-18,22-27,33H,4-10,13-16,19-21,28H2,1-3H3,(H,40,45)(H,41,46)