phenethyl 4-(4-methoxyphenyl)-2-nitroso-butanoate

Systemtic Name: phenethyl 4-(4-methoxyphenyl)-2-nitroso-butanoate Openeye Name: phenethyl 4-(4-methoxyphenyl)-2-nitroso-butanoate CAS Name: 4-(4-methoxyphenyl)-2-nitrosobutanoic acid phenethyl ester IUPAC Name: phenethyl 4-(4-methoxyphenyl)-2-nitrosobutanoate Traditional Name: 4-(4-methoxyphenyl)-2-nitroso-butyric acid phenethyl ester Formula: C19H21NO4 MolecularWeight: 327.37434

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(C(=O)OCCC2=CC=CC=C2)N=O

Isomeric SMILES

COC1=CC=C(C=C1)CCC(C(=O)OCCC2=CC=CC=C2)N=O

InChI

InChI=1S/C19H21NO4/c1-23-17-10-7-16(8-11-17)9-12-18(20-22)19(21)24-14-13-15-5-3-2-4-6-15/h2-8,10-11,18H,9,12-14H2,1H3