(2-dodecoxy-2-oxidanylidene-ethyl) (2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-ethanoate

Systemtic Name: (2-dodecoxy-2-oxidanylidene-ethyl) (2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-ethanoate Openeye Name: (2-dodecoxy-2-oxo-ethyl) (2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-acetate CAS Name: (2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitrosoacetic acid (2-dodecoxy-2-oxoethyl) ester IUPAC Name: (2-dodecoxy-2-oxoethyl) (2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitrosoacetate Traditional Name: (2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-acetic acid (2-keto-2-lauryloxy-ethyl) ester Formula: C32H50N2O5 MolecularWeight: 542.7498

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)COC(=O)C(=C1C2=C(C(=CC=C2)C)C(CN1)(CCC)CCC)N=O

Isomeric SMILES

CCCCCCCCCCCCOC(=O)COC(=O)/C(=C/1\C2=C(C(=CC=C2)C)C(CN1)(CCC)CCC)/N=O

InChI

InChI=1S/C32H50N2O5/c1-5-8-9-10-11-12-13-14-15-16-22-38-27(35)23-39-31(36)30(34-37)29-26-19-17-18-25(4)28(26)32(20-6-2,21-7-3)24-33-29/h17-19,33H,5-16,20-24H2,1-4H3/b30-29-