6-(prop-1-en-2-yloxymethoxy)hexyl 4-(3-oxidanylidenebutanoylamino)benzoate

Systemtic Name: 6-(prop-1-en-2-yloxymethoxy)hexyl 4-(3-oxidanylidenebutanoylamino)benzoate Openeye Name: 6-(isopropenyloxymethoxy)hexyl 4-(3-oxobutanoylamino)benzoate CAS Name: 4-(1,3-dioxobutylamino)benzoic acid 6-(1-methylethenoxymethoxy)hexyl ester IUPAC Name: 6-(prop-1-en-2-yloxymethoxy)hexyl 4-(3-oxobutanoylamino)benzoate Traditional Name: 4-(acetoacetylamino)benzoic acid 6-(isopropenyloxymethoxy)hexyl ester Formula: C21H29NO6 MolecularWeight: 391.45806

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)OCOCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC(=O)C

Isomeric SMILES

CC(=C)OCOCCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)CC(=O)C

InChI

InChI=1S/C21H29NO6/c1-16(2)28-15-26-12-6-4-5-7-13-27-21(25)18-8-10-19(11-9-18)22-20(24)14-17(3)23/h8-11H,1,4-7,12-15H2,2-3H3,(H,22,24)