methyl 3-(2-bromanyl-4-methoxy-5-phenylmethoxy-phenyl)-2-[(phenylmethylidene)amino]propanoate

Systemtic Name: methyl 3-(2-bromanyl-4-methoxy-5-phenylmethoxy-phenyl)-2-[(phenylmethylidene)amino]propanoate Openeye Name: methyl 2-(benzylideneamino)-3-(5-benzyloxy-2-bromo-4-methoxy-phenyl)propanoate CAS Name: 3-(2-bromo-4-methoxy-5-phenylmethoxyphenyl)-2-[(phenylmethylene)amino]propanoic acid methyl ester IUPAC Name: methyl 2-(benzylideneamino)-3-(2-bromo-4-methoxy-5-phenylmethoxyphenyl)propanoate Traditional Name: 2-(benzalamino)-3-(5-benzoxy-2-bromo-4-methoxy-phenyl)propionic acid methyl ester Formula: C25H24BrNO4 MolecularWeight: 482.36636

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)CC(C(=O)OC)N=CC2=CC=CC=C2)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)CC(C(=O)OC)N=CC2=CC=CC=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24BrNO4/c1-29-23-15-21(26)20(14-24(23)31-17-19-11-7-4-8-12-19)13-22(25(28)30-2)27-16-18-9-5-3-6-10-18/h3-12,14-16,22H,13,17H2,1-2H3