[2-[cyclohexen-1-yl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 4-methoxybenzoate

Systemtic Name: [2-[cyclohexen-1-yl(furan-2-ylmethyl)amino]-2-oxidanylidene-ethyl] 4-methoxybenzoate Openeye Name: [2-[cyclohexen-1-yl(2-furylmethyl)amino]-2-oxo-ethyl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [2-[1-cyclohexenyl(2-furanylmethyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[cyclohexen-1-yl(furan-2-ylmethyl)amino]-2-oxoethyl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [2-[cyclohexen-1-yl(2-furfuryl)amino]-2-keto-ethyl] ester Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)OCC(=O)N(CC2=CC=CO2)C3=CCCCC3

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)OCC(=O)N(CC2=CC=CO2)C3=CCCCC3

InChI

InChI=1S/C21H23NO5/c1-25-18-11-9-16(10-12-18)21(24)27-15-20(23)22(14-19-8-5-13-26-19)17-6-3-2-4-7-17/h5-6,8-13H,2-4,7,14-15H2,1H3