2-methylpropyl 4-[5-(2-methylpropylamino)pentanoylamino]benzoate

Systemtic Name: 2-methylpropyl 4-[5-(2-methylpropylamino)pentanoylamino]benzoate Openeye Name: isobutyl 4-[5-(isobutylamino)pentanoylamino]benzoate CAS Name: 4-[[5-(2-methylpropylamino)-1-oxopentyl]amino]benzoic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 4-[5-(2-methylpropylamino)pentanoylamino]benzoate Traditional Name: 4-[5-(isobutylamino)pentanoylamino]benzoic acid isobutyl ester Formula: C20H32N2O3 MolecularWeight: 348.47968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNCCCCC(=O)NC1=CC=C(C=C1)C(=O)OCC(C)C

Isomeric SMILES

CC(C)CNCCCCC(=O)NC1=CC=C(C=C1)C(=O)OCC(C)C

InChI

InChI=1S/C20H32N2O3/c1-15(2)13-21-12-6-5-7-19(23)22-18-10-8-17(9-11-18)20(24)25-14-16(3)4/h8-11,15-16,21H,5-7,12-14H2,1-4H3,(H,22,23)