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

Systemtic Name: methyl 2-[[[5-bromanyl-2-(phenylmethoxycarbonylamino)phenyl]-phenyl-methyl]amino]ethanoate Openeye Name: methyl 2-[[[2-(benzyloxycarbonylamino)-5-bromo-phenyl]-phenyl-methyl]amino]acetate CAS Name: 2-[[[5-bromo-2-(phenylmethoxycarbonylamino)phenyl]-phenylmethyl]amino]acetic acid methyl ester IUPAC Name: methyl 2-[[[5-bromo-2-(phenylmethoxycarbonylamino)phenyl]-phenylmethyl]amino]acetate Traditional Name: 2-[[[2-(benzyloxycarbonylamino)-5-bromo-phenyl]-phenyl-methyl]amino]acetic acid methyl ester Formula: C24H23BrN2O4 MolecularWeight: 483.35442

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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)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)CNC(C1=CC=CC=C1)C2=C(C=CC(=C2)Br)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C24H23BrN2O4/c1-30-22(28)15-26-23(18-10-6-3-7-11-18)20-14-19(25)12-13-21(20)27-24(29)31-16-17-8-4-2-5-9-17/h2-14,23,26H,15-16H2,1H3,(H,27,29)