(phenylmethyl) 2-[[3-(aminocarbonylamino)-3-(3-bromophenyl)propanoyl]amino]ethanoate

Systemtic Name: (phenylmethyl) 2-[[3-(aminocarbonylamino)-3-(3-bromophenyl)propanoyl]amino]ethanoate Openeye Name: benzyl 2-[[3-(3-bromophenyl)-3-ureido-propanoyl]amino]acetate CAS Name: 2-[[3-(3-bromophenyl)-3-(carbamoylamino)-1-oxopropyl]amino]acetic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[[3-(3-bromophenyl)-3-(carbamoylamino)propanoyl]amino]acetate Traditional Name: 2-[[3-(3-bromophenyl)-3-ureido-propanoyl]amino]acetic acid benzyl ester Formula: C19H20BrN3O4 MolecularWeight: 434.2838

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)CNC(=O)CC(C2=CC(=CC=C2)Br)NC(=O)N

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)CNC(=O)CC(C2=CC(=CC=C2)Br)NC(=O)N

InChI

InChI=1S/C19H20BrN3O4/c20-15-8-4-7-14(9-15)16(23-19(21)26)10-17(24)22-11-18(25)27-12-13-5-2-1-3-6-13/h1-9,16H,10-12H2,(H,22,24)(H3,21,23,26)