methyl 2-[3-(2,4-dimethylphenyl)propanoylamino]-5-morpholin-4-yl-benzoate

Systemtic Name: methyl 2-[3-(2,4-dimethylphenyl)propanoylamino]-5-morpholin-4-yl-benzoate Openeye Name: methyl 2-[3-(2,4-dimethylphenyl)propanoylamino]-5-morpholino-benzoate CAS Name: 2-[[3-(2,4-dimethylphenyl)-1-oxopropyl]amino]-5-(4-morpholinyl)benzoic acid methyl ester IUPAC Name: methyl 2-[3-(2,4-dimethylphenyl)propanoylamino]-5-morpholin-4-ylbenzoate Traditional Name: 2-[3-(2,4-dimethylphenyl)propanoylamino]-5-morpholino-benzoic acid methyl ester Formula: C23H28N2O4 MolecularWeight: 396.47942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)N3CCOCC3)C(=O)OC)C

Isomeric SMILES

CC1=CC(=C(C=C1)CCC(=O)NC2=C(C=C(C=C2)N3CCOCC3)C(=O)OC)C

InChI

InChI=1S/C23H28N2O4/c1-16-4-5-18(17(2)14-16)6-9-22(26)24-21-8-7-19(15-20(21)23(27)28-3)25-10-12-29-13-11-25/h4-5,7-8,14-15H,6,9-13H2,1-3H3,(H,24,26)