methyl 2-[[[5-bromanyl-2-(3-chloranylpropanoylamino)phenyl]-phenyl-methyl]amino]ethanoate

Systemtic Name: methyl 2-[[[5-bromanyl-2-(3-chloranylpropanoylamino)phenyl]-phenyl-methyl]amino]ethanoate Openeye Name: methyl 2-[[[5-bromo-2-(3-chloropropanoylamino)phenyl]-phenyl-methyl]amino]acetate CAS Name: 2-[[[5-bromo-2-[(3-chloro-1-oxopropyl)amino]phenyl]-phenylmethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[[5-bromo-2-(3-chloropropanoylamino)phenyl]-phenylmethyl]amino]acetate Traditional Name: 2-[[[5-bromo-2-(3-chloropropanoylamino)phenyl]-phenyl-methyl]amino]acetic acid methyl ester Formula: C19H20BrClN2O3 MolecularWeight: 439.7307

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20BrClN2O3/c1-26-18(25)12-22-19(13-5-3-2-4-6-13)15-11-14(20)7-8-16(15)23-17(24)9-10-21/h2-8,11,19,22H,9-10,12H2,1H3,(H,23,24)