3-phenylpropyl 5-oxidanylidene-5-[2-[[5-oxidanylidene-5-(3-phenylpropoxy)pentanoyl]-phenyl-amino]ethyl-phenyl-amino]pentanoate

Systemtic Name: 3-phenylpropyl 5-oxidanylidene-5-[2-[[5-oxidanylidene-5-(3-phenylpropoxy)pentanoyl]-phenyl-amino]ethyl-phenyl-amino]pentanoate Openeye Name: 3-phenylpropyl 5-oxo-5-[N-[2-(N-[5-oxo-5-(3-phenylpropoxy)pentanoyl]anilino)ethyl]anilino]pentanoate CAS Name: 5-[N-[2-(N-[1,5-dioxo-5-(3-phenylpropoxy)pentyl]anilino)ethyl]anilino]-5-oxopentanoic acid 3-phenylpropyl ester IUPAC Name: 3-phenylpropyl 5-oxo-5-[N-[2-(N-[5-oxo-5-(3-phenylpropoxy)pentanoyl]anilino)ethyl]anilino]pentanoate Traditional Name: 5-keto-5-[N-[2-(N-[5-keto-5-(3-phenylpropoxy)pentanoyl]anilino)ethyl]anilino]valeric acid 3-phenylpropyl ester Formula: C42H48N2O6 MolecularWeight: 676.84032

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)N(CCN(C2=CC=CC=C2)C(=O)CCCC(=O)OCCCC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCCOC(=O)CCCC(=O)N(CCN(C2=CC=CC=C2)C(=O)CCCC(=O)OCCCC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C42H48N2O6/c45-39(27-13-29-41(47)49-33-15-21-35-17-5-1-6-18-35)43(37-23-9-3-10-24-37)31-32-44(38-25-11-4-12-26-38)40(46)28-14-30-42(48)50-34-16-22-36-19-7-2-8-20-36/h1-12,17-20,23-26H,13-16,21-22,27-34H2