methyl 2-[3-[(4-bromophenyl)carbonylamino]propanoyl-(phenylmethyl)amino]ethanoate

Systemtic Name: methyl 2-[3-[(4-bromophenyl)carbonylamino]propanoyl-(phenylmethyl)amino]ethanoate Openeye Name: methyl 2-[benzyl-[3-[(4-bromobenzoyl)amino]propanoyl]amino]acetate CAS Name: 2-[[3-[[(4-bromophenyl)-oxomethyl]amino]-1-oxopropyl]-(phenylmethyl)amino]acetic acid methyl ester IUPAC Name: methyl 2-[benzyl-[3-[(4-bromobenzoyl)amino]propanoyl]amino]acetate Traditional Name: 2-[benzyl-[3-[(4-bromobenzoyl)amino]propanoyl]amino]acetic acid methyl ester Formula: C20H21BrN2O4 MolecularWeight: 433.29574

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(CC1=CC=CC=C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Br

Isomeric SMILES

COC(=O)CN(CC1=CC=CC=C1)C(=O)CCNC(=O)C2=CC=C(C=C2)Br

InChI

InChI=1S/C20H21BrN2O4/c1-27-19(25)14-23(13-15-5-3-2-4-6-15)18(24)11-12-22-20(26)16-7-9-17(21)10-8-16/h2-10H,11-14H2,1H3,(H,22,26)