phenyl 2-[3-[4-(2,4-dipentylphenoxy)butylcarbamoyl]-4-oxidanyl-naphthalen-1-yl]oxyethanoate

Systemtic Name: phenyl 2-[3-[4-(2,4-dipentylphenoxy)butylcarbamoyl]-4-oxidanyl-naphthalen-1-yl]oxyethanoate Openeye Name: phenyl 2-[[3-[4-(2,4-dipentylphenoxy)butylcarbamoyl]-4-hydroxy-1-naphthyl]oxy]acetate CAS Name: 2-[[3-[[4-(2,4-dipentylphenoxy)butylamino]-oxomethyl]-4-hydroxy-1-naphthalenyl]oxy]acetic acid phenyl ester IUPAC Name: phenyl 2-[3-[4-(2,4-dipentylphenoxy)butylcarbamoyl]-4-hydroxynaphthalen-1-yl]oxyacetate Traditional Name: 2-[3-[4-(2,4-diamylphenoxy)butylcarbamoyl]-4-hydroxy-1-naphthoxy]acetic acid phenyl ester Formula: C39H47NO6 MolecularWeight: 625.79358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OCC(=O)OC4=CC=CC=C4)O)CCCCC

Isomeric SMILES

CCCCCC1=CC(=C(C=C1)OCCCCNC(=O)C2=C(C3=CC=CC=C3C(=C2)OCC(=O)OC4=CC=CC=C4)O)CCCCC

InChI

InChI=1S/C39H47NO6/c1-3-5-8-16-29-22-23-35(30(26-29)17-9-6-4-2)44-25-15-14-24-40-39(43)34-27-36(32-20-12-13-21-33(32)38(34)42)45-28-37(41)46-31-18-10-7-11-19-31/h7,10-13,18-23,26-27,42H,3-6,8-9,14-17,24-25,28H2,1-2H3,(H,40,43)