[1-[2-(cyclohexen-1-yl)ethylamino]-1-oxidanylidene-propan-2-yl] 2,6-dimethoxybenzoate

Systemtic Name: [1-[2-(cyclohexen-1-yl)ethylamino]-1-oxidanylidene-propan-2-yl] 2,6-dimethoxybenzoate Openeye Name: [2-[2-(cyclohexen-1-yl)ethylamino]-1-methyl-2-oxo-ethyl] 2,6-dimethoxybenzoate CAS Name: 2,6-dimethoxybenzoic acid [1-[2-(1-cyclohexenyl)ethylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[2-(cyclohexen-1-yl)ethylamino]-1-oxopropan-2-yl] 2,6-dimethoxybenzoate Traditional Name: 2,6-dimethoxybenzoic acid [2-[2-(cyclohexen-1-yl)ethylamino]-2-keto-1-methyl-ethyl] ester Formula: C20H27NO5 MolecularWeight: 361.43208

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCCC1=CCCCC1)OC(=O)C2=C(C=CC=C2OC)OC

Isomeric SMILES

CC(C(=O)NCCC1=CCCCC1)OC(=O)C2=C(C=CC=C2OC)OC

InChI

InChI=1S/C20H27NO5/c1-14(19(22)21-13-12-15-8-5-4-6-9-15)26-20(23)18-16(24-2)10-7-11-17(18)25-3/h7-8,10-11,14H,4-6,9,12-13H2,1-3H3,(H,21,22)