methyl 2-[(5-bromanyl-2-propoxy-phenyl)carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 2-[(5-bromanyl-2-propoxy-phenyl)carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 2-[(5-bromo-2-propoxy-benzoyl)amino]-3-phenyl-propanoate CAS Name: 2-[[(5-bromo-2-propoxyphenyl)-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 2-[(5-bromo-2-propoxybenzoyl)amino]-3-phenylpropanoate Traditional Name: 2-[(5-bromo-2-propoxy-benzoyl)amino]-3-phenyl-propionic acid methyl ester Formula: C20H22BrNO4 MolecularWeight: 420.29698

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)C(=O)NC(CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C20H22BrNO4/c1-3-11-26-18-10-9-15(21)13-16(18)19(23)22-17(20(24)25-2)12-14-7-5-4-6-8-14/h4-10,13,17H,3,11-12H2,1-2H3,(H,22,23)