methyl 13-[[2-ethyl-5-[4-(4-pentylcyclohexyl)phenyl]phenyl]amino]-13-oxidanylidene-tridecanoate

Systemtic Name: methyl 13-[[2-ethyl-5-[4-(4-pentylcyclohexyl)phenyl]phenyl]amino]-13-oxidanylidene-tridecanoate Openeye Name: methyl 13-[2-ethyl-5-[4-(4-pentylcyclohexyl)phenyl]anilino]-13-oxo-tridecanoate CAS Name: 13-[2-ethyl-5-[4-(4-pentylcyclohexyl)phenyl]anilino]-13-oxotridecanoic acid methyl ester IUPAC Name: methyl 13-[2-ethyl-5-[4-(4-pentylcyclohexyl)phenyl]anilino]-13-oxotridecanoate Traditional Name: 13-[5-[4-(4-amylcyclohexyl)phenyl]-2-ethyl-anilino]-13-keto-tridecanoic acid methyl ester Formula: C39H59NO3 MolecularWeight: 589.89066

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)CC)NC(=O)CCCCCCCCCCCC(=O)OC

Isomeric SMILES

CCCCCC1CCC(CC1)C2=CC=C(C=C2)C3=CC(=C(C=C3)CC)NC(=O)CCCCCCCCCCCC(=O)OC

InChI

InChI=1S/C39H59NO3/c1-4-6-14-17-31-20-22-33(23-21-31)34-25-27-35(28-26-34)36-29-24-32(5-2)37(30-36)40-38(41)18-15-12-10-8-7-9-11-13-16-19-39(42)43-3/h24-31,33H,4-23H2,1-3H3,(H,40,41)