methyl 2-azanyl-3-(2-bromanyl-4-methoxy-5-phenylmethoxy-phenyl)propanoate

Systemtic Name: methyl 2-azanyl-3-(2-bromanyl-4-methoxy-5-phenylmethoxy-phenyl)propanoate Openeye Name: methyl 2-amino-3-(5-benzyloxy-2-bromo-4-methoxy-phenyl)propanoate CAS Name: 2-amino-3-(2-bromo-4-methoxy-5-phenylmethoxyphenyl)propanoic acid methyl ester IUPAC Name: methyl 2-amino-3-(2-bromo-4-methoxy-5-phenylmethoxyphenyl)propanoate Traditional Name: 2-amino-3-(5-benzoxy-2-bromo-4-methoxy-phenyl)propionic acid methyl ester Formula: C18H20BrNO4 MolecularWeight: 394.2597

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C(=C1)Br)CC(C(=O)OC)N)OCC2=CC=CC=C2

Isomeric SMILES

COC1=C(C=C(C(=C1)Br)CC(C(=O)OC)N)OCC2=CC=CC=C2

InChI

InChI=1S/C18H20BrNO4/c1-22-16-10-14(19)13(8-15(20)18(21)23-2)9-17(16)24-11-12-6-4-3-5-7-12/h3-7,9-10,15H,8,11,20H2,1-2H3