[1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-butoxybenzoate

Systemtic Name: [1-(cyclopropylamino)-1-oxidanylidene-propan-2-yl] 4-butoxybenzoate Openeye Name: [2-(cyclopropylamino)-1-methyl-2-oxo-ethyl] 4-butoxybenzoate CAS Name: 4-butoxybenzoic acid [1-(cyclopropylamino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(cyclopropylamino)-1-oxopropan-2-yl] 4-butoxybenzoate Traditional Name: 4-butoxybenzoic acid [2-(cyclopropylamino)-2-keto-1-methyl-ethyl] ester Formula: C17H23NO4 MolecularWeight: 305.36882

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2CC2

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)OC(C)C(=O)NC2CC2

InChI

InChI=1S/C17H23NO4/c1-3-4-11-21-15-9-5-13(6-10-15)17(20)22-12(2)16(19)18-14-7-8-14/h5-6,9-10,12,14H,3-4,7-8,11H2,1-2H3,(H,18,19)