methyl (3S)-3-[(4-bromanyl-3,5-dimethoxy-phenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl (3S)-3-[(4-bromanyl-3,5-dimethoxy-phenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl (3S)-3-[(4-bromo-3,5-dimethoxy-benzoyl)amino]-3-phenyl-propanoate CAS Name: (3S)-3-[[(4-bromo-3,5-dimethoxyphenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (3S)-3-[(4-bromo-3,5-dimethoxybenzoyl)amino]-3-phenylpropanoate Traditional Name: (3S)-3-[(4-bromo-3,5-dimethoxy-benzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C19H20BrNO5 MolecularWeight: 422.2698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1Br)OC)C(=O)NC(CC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

COC1=CC(=CC(=C1Br)OC)C(=O)N[C@@H](CC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C19H20BrNO5/c1-24-15-9-13(10-16(25-2)18(15)20)19(23)21-14(11-17(22)26-3)12-7-5-4-6-8-12/h4-10,14H,11H2,1-3H3,(H,21,23)/t14-/m0/s1