methyl 4-[(E)-3-[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]benzoate

Systemtic Name: methyl 4-[(E)-3-[(2S)-1-(2-methylpropylamino)-1-oxidanylidene-propan-2-yl]oxy-3-oxidanylidene-prop-1-enyl]benzoate Openeye Name: methyl 4-[(E)-3-[(1S)-2-(isobutylamino)-1-methyl-2-oxo-ethoxy]-3-oxo-prop-1-enyl]benzoate CAS Name: 4-[(E)-3-[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]oxy-3-oxoprop-1-enyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(E)-3-[(2S)-1-(2-methylpropylamino)-1-oxopropan-2-yl]oxy-3-oxoprop-1-enyl]benzoate Traditional Name: 4-[(E)-3-[(1S)-2-(isobutylamino)-2-keto-1-methyl-ethoxy]-3-keto-prop-1-enyl]benzoic acid methyl ester Formula: C18H23NO5 MolecularWeight: 333.37892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)OC(=O)C=CC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)OC(=O)/C=C/C1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C18H23NO5/c1-12(2)11-19-17(21)13(3)24-16(20)10-7-14-5-8-15(9-6-14)18(22)23-4/h5-10,12-13H,11H2,1-4H3,(H,19,21)/b10-7+/t13-/m0/s1