2-[4-[[(5R)-5-(4-methoxyphenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]phenyl]ethanoate

Systemtic Name: 2-[4-[[(5R)-5-(4-methoxyphenyl)-3-oxidanylidene-cyclohexen-1-yl]amino]phenyl]ethanoate Openeye Name: 2-[4-[[(5R)-5-(4-methoxyphenyl)-3-oxo-cyclohexen-1-yl]amino]phenyl]acetate CAS Name: 2-[4-[[(5R)-5-(4-methoxyphenyl)-3-oxo-1-cyclohexenyl]amino]phenyl]acetate IUPAC Name: 2-[4-[[(5R)-5-(4-methoxyphenyl)-3-oxocyclohexen-1-yl]amino]phenyl]acetate Traditional Name: 2-[4-[[(5R)-3-keto-5-(4-methoxyphenyl)cyclohexen-1-yl]amino]phenyl]acetate Formula: C21H20NO4- MolecularWeight: 350.3878

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CC(=CC(=O)C2)NC3=CC=C(C=C3)CC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H]2CC(=CC(=O)C2)NC3=CC=C(C=C3)CC(=O)[O-]

InChI

InChI=1S/C21H21NO4/c1-26-20-8-4-15(5-9-20)16-11-18(13-19(23)12-16)22-17-6-2-14(3-7-17)10-21(24)25/h2-9,13,16,22H,10-12H2,1H3,(H,24,25)/p-1/t16-/m1/s1