[1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-[(3-methylphenyl)methoxy]benzoate

Systemtic Name: [1-oxidanylidene-1-(prop-2-enylamino)propan-2-yl] 3-[(3-methylphenyl)methoxy]benzoate Openeye Name: [2-(allylamino)-1-methyl-2-oxo-ethyl] 3-(m-tolylmethoxy)benzoate CAS Name: 3-[(3-methylphenyl)methoxy]benzoic acid [1-oxo-1-(prop-2-enylamino)propan-2-yl] ester IUPAC Name: [1-oxo-1-(prop-2-enylamino)propan-2-yl] 3-[(3-methylphenyl)methoxy]benzoate Traditional Name: 3-(3-methylbenzyl)oxybenzoic acid [2-(allylamino)-2-keto-1-methyl-ethyl] ester Formula: C21H23NO4 MolecularWeight: 353.41162

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)COC2=CC=CC(=C2)C(=O)OC(C)C(=O)NCC=C

Isomeric SMILES

CC1=CC(=CC=C1)COC2=CC=CC(=C2)C(=O)OC(C)C(=O)NCC=C

InChI

InChI=1S/C21H23NO4/c1-4-11-22-20(23)16(3)26-21(24)18-9-6-10-19(13-18)25-14-17-8-5-7-15(2)12-17/h4-10,12-13,16H,1,11,14H2,2-3H3,(H,22,23)