(1-azanyl-1-oxidanylidene-propan-2-yl) 3-bromanyl-5-methoxy-4-phenylmethoxy-benzoate

Systemtic Name: (1-azanyl-1-oxidanylidene-propan-2-yl) 3-bromanyl-5-methoxy-4-phenylmethoxy-benzoate Openeye Name: (2-amino-1-methyl-2-oxo-ethyl) 4-benzyloxy-3-bromo-5-methoxy-benzoate CAS Name: 3-bromo-5-methoxy-4-phenylmethoxybenzoic acid (1-amino-1-oxopropan-2-yl) ester IUPAC Name: (1-amino-1-oxopropan-2-yl) 3-bromo-5-methoxy-4-phenylmethoxybenzoate Traditional Name: 4-benzoxy-3-bromo-5-methoxy-benzoic acid (2-amino-2-keto-1-methyl-ethyl) ester Formula: C18H18BrNO5 MolecularWeight: 408.24322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18BrNO5/c1-11(17(20)21)25-18(22)13-8-14(19)16(15(9-13)23-2)24-10-12-6-4-3-5-7-12/h3-9,11H,10H2,1-2H3,(H2,20,21)