butyl 2-[(2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-ethanoyl]oxyundecanoate

Systemtic Name: butyl 2-[(2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-ethanoyl]oxyundecanoate Openeye Name: butyl 2-[(2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-acetyl]oxyundecanoate CAS Name: 2-[(2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-1-oxoethoxy]undecanoic acid butyl ester IUPAC Name: butyl 2-[(2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitrosoacetyl]oxyundecanoate Traditional Name: 2-[(2Z)-2-(5-methyl-4,4-dipropyl-2,3-dihydroisoquinolin-1-ylidene)-2-nitroso-acetyl]oxyundecanoic acid butyl ester Formula: C33H52N2O5 MolecularWeight: 556.77638

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(C(=O)OCCCC)OC(=O)C(=C1C2=C(C(=CC=C2)C)C(CN1)(CCC)CCC)N=O

Isomeric SMILES

CCCCCCCCCC(C(=O)OCCCC)OC(=O)/C(=C/1\C2=C(C(=CC=C2)C)C(CN1)(CCC)CCC)/N=O

InChI

InChI=1S/C33H52N2O5/c1-6-10-12-13-14-15-16-20-27(31(36)39-23-11-7-2)40-32(37)30(35-38)29-26-19-17-18-25(5)28(26)33(21-8-3,22-9-4)24-34-29/h17-19,27,34H,6-16,20-24H2,1-5H3/b30-29-