methyl 3-(4-hexoxyphenyl)-3-isocyano-propanoate

Systemtic Name: methyl 3-(4-hexoxyphenyl)-3-isocyano-propanoate Openeye Name: methyl 3-(4-hexoxyphenyl)-3-isocyano-propanoate CAS Name: 3-(4-hexoxyphenyl)-3-isocyanopropanoic acid methyl ester IUPAC Name: methyl 3-(4-hexoxyphenyl)-3-isocyanopropanoate Traditional Name: 3-(4-hexoxyphenyl)-3-isocyano-propionic acid methyl ester Formula: C17H23NO3 MolecularWeight: 289.36942

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(CC(=O)OC)[N+]#[C-]

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(CC(=O)OC)[N+]#[C-]

InChI

InChI=1S/C17H23NO3/c1-4-5-6-7-12-21-15-10-8-14(9-11-15)16(18-2)13-17(19)20-3/h8-11,16H,4-7,12-13H2,1,3H3