[2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(hexanoylamino)-4,5-dimethoxy-benzoate

Systemtic Name: [2-oxidanylidene-2-(pentan-3-ylamino)ethyl] 2-(hexanoylamino)-4,5-dimethoxy-benzoate Openeye Name: [2-(1-ethylpropylamino)-2-oxo-ethyl] 2-(hexanoylamino)-4,5-dimethoxy-benzoate CAS Name: 4,5-dimethoxy-2-(1-oxohexylamino)benzoic acid [2-oxo-2-(pentan-3-ylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentan-3-ylamino)ethyl] 2-(hexanoylamino)-4,5-dimethoxybenzoate Traditional Name: 2-(caproylamino)-4,5-dimethoxy-benzoic acid [2-(1-ethylpropylamino)-2-keto-ethyl] ester Formula: C22H34N2O6 MolecularWeight: 422.51516

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)NC(CC)CC)OC)OC

Isomeric SMILES

CCCCCC(=O)NC1=CC(=C(C=C1C(=O)OCC(=O)NC(CC)CC)OC)OC

InChI

InChI=1S/C22H34N2O6/c1-6-9-10-11-20(25)24-17-13-19(29-5)18(28-4)12-16(17)22(27)30-14-21(26)23-15(7-2)8-3/h12-13,15H,6-11,14H2,1-5H3,(H,23,26)(H,24,25)