butyl 4-[2-(phenylcarbamoylamino)propanoylamino]benzoate

Systemtic Name: butyl 4-[2-(phenylcarbamoylamino)propanoylamino]benzoate Openeye Name: butyl 4-[2-(phenylcarbamoylamino)propanoylamino]benzoate CAS Name: 4-[[2-[[anilino(oxo)methyl]amino]-1-oxopropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 4-[2-(phenylcarbamoylamino)propanoylamino]benzoate Traditional Name: 4-[2-(phenylcarbamoylamino)propanoylamino]benzoic acid butyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)NC(=O)NC2=CC=CC=C2

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)NC(=O)C(C)NC(=O)NC2=CC=CC=C2

InChI

InChI=1S/C21H25N3O4/c1-3-4-14-28-20(26)16-10-12-18(13-11-16)23-19(25)15(2)22-21(27)24-17-8-6-5-7-9-17/h5-13,15H,3-4,14H2,1-2H3,(H,23,25)(H2,22,24,27)