[1-[2-[(4-dodecoxyphenoxy)methylamino]-5-(ethoxycarbonylamino)naphthalen-1-yl]-2-ethoxy-2-oxidanylidene-ethyl] propanoate

Systemtic Name: [1-[2-[(4-dodecoxyphenoxy)methylamino]-5-(ethoxycarbonylamino)naphthalen-1-yl]-2-ethoxy-2-oxidanylidene-ethyl] propanoate Openeye Name: [1-[2-[(4-dodecoxyphenoxy)methylamino]-5-(ethoxycarbonylamino)-1-naphthyl]-2-ethoxy-2-oxo-ethyl] propanoate CAS Name: propanoic acid [1-[2-[(4-dodecoxyphenoxy)methylamino]-5-(ethoxycarbonylamino)-1-naphthalenyl]-2-ethoxy-2-oxoethyl] ester IUPAC Name: [1-[2-[(4-dodecoxyphenoxy)methylamino]-5-(ethoxycarbonylamino)naphthalen-1-yl]-2-ethoxy-2-oxoethyl] propanoate Traditional Name: propionic acid [1-[5-(carbethoxyamino)-2-[(4-lauryloxyphenoxy)methylamino]-1-naphthyl]-2-ethoxy-2-keto-ethyl] ester Formula: C39H54N2O8 MolecularWeight: 678.85466

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC1=CC=C(C=C1)OCNC2=C(C3=C(C=C2)C(=CC=C3)NC(=O)OCC)C(C(=O)OCC)OC(=O)CC

Isomeric SMILES

CCCCCCCCCCCCOC1=CC=C(C=C1)OCNC2=C(C3=C(C=C2)C(=CC=C3)NC(=O)OCC)C(C(=O)OCC)OC(=O)CC

InChI

InChI=1S/C39H54N2O8/c1-5-9-10-11-12-13-14-15-16-17-27-47-29-21-23-30(24-22-29)48-28-40-34-26-25-31-32(19-18-20-33(31)41-39(44)46-8-4)36(34)37(38(43)45-7-3)49-35(42)6-2/h18-26,37,40H,5-17,27-28H2,1-4H3,(H,41,44)