methyl 4-[[(3-bromanyl-5-methoxy-4-propoxy-phenyl)carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[(3-bromanyl-5-methoxy-4-propoxy-phenyl)carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[(3-bromo-5-methoxy-4-propoxy-benzoyl)amino]methyl]benzoate CAS Name: 4-[[[(3-bromo-5-methoxy-4-propoxyphenyl)-oxomethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(3-bromo-5-methoxy-4-propoxybenzoyl)amino]methyl]benzoate Traditional Name: 4-[[(3-bromo-5-methoxy-4-propoxy-benzoyl)amino]methyl]benzoic acid methyl ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1Br)C(=O)NCC2=CC=C(C=C2)C(=O)OC)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1Br)C(=O)NCC2=CC=C(C=C2)C(=O)OC)OC

InChI

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