methyl 2-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(3-bromanyl-4-ethoxy-5-methoxy-phenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(3-bromo-4-ethoxy-5-methoxyphenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(3-bromo-4-ethoxy-5-methoxybenzoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(3-bromo-4-ethoxy-5-methoxy-benzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1Br)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)OC

Isomeric SMILES

CCOC1=C(C=C(C=C1Br)C(=O)NC(CC2=CC=CC=C2)C(=O)OC)OC

InChI

InChI=1S/C20H22BrNO5/c1-4-27-18-15(21)11-14(12-17(18)25-2)19(23)22-16(20(24)26-3)10-13-8-6-5-7-9-13/h5-9,11-12,16H,4,10H2,1-3H3,(H,22,23)