2-methylpropyl 3-[(3-methylphenyl)-[3-(2-methylpropoxy)-3-oxidanylidene-propyl]amino]propanoate

Systemtic Name: 2-methylpropyl 3-[(3-methylphenyl)-[3-(2-methylpropoxy)-3-oxidanylidene-propyl]amino]propanoate Openeye Name: isobutyl 3-(N-(3-isobutoxy-3-oxo-propyl)-3-methyl-anilino)propanoate CAS Name: 3-(3-methyl-N-[3-(2-methylpropoxy)-3-oxopropyl]anilino)propanoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(3-methyl-N-[3-(2-methylpropoxy)-3-oxopropyl]anilino)propanoate Traditional Name: 3-(N-(3-isobutoxy-3-keto-propyl)-3-methyl-anilino)propionic acid isobutyl ester Formula: C21H33NO4 MolecularWeight: 363.49102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CCC(=O)OCC(C)C)CCC(=O)OCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CCC(=O)OCC(C)C)CCC(=O)OCC(C)C

InChI

InChI=1S/C21H33NO4/c1-16(2)14-25-20(23)9-11-22(19-8-6-7-18(5)13-19)12-10-21(24)26-15-17(3)4/h6-8,13,16-17H,9-12,14-15H2,1-5H3