ethyl 3-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate

Systemtic Name: ethyl 3-[2-(4-bromanyl-2-propan-2-yl-phenoxy)ethanoyl-(phenylmethyl)amino]propanoate Openeye Name: ethyl 3-[benzyl-[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]propanoate CAS Name: 3-[[2-(4-bromo-2-propan-2-ylphenoxy)-1-oxoethyl]-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[benzyl-[2-(4-bromo-2-propan-2-ylphenoxy)acetyl]amino]propanoate Traditional Name: 3-[benzyl-[2-(4-bromo-2-isopropyl-phenoxy)acetyl]amino]propionic acid ethyl ester Formula: C23H28BrNO4 MolecularWeight: 462.37672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)Br)C(C)C

Isomeric SMILES

CCOC(=O)CCN(CC1=CC=CC=C1)C(=O)COC2=C(C=C(C=C2)Br)C(C)C

InChI

InChI=1S/C23H28BrNO4/c1-4-28-23(27)12-13-25(15-18-8-6-5-7-9-18)22(26)16-29-21-11-10-19(24)14-20(21)17(2)3/h5-11,14,17H,4,12-13,15-16H2,1-3H3