methyl 4-[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate

Systemtic Name: methyl 4-[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxidanylidene-ethoxy]-3-methoxy-benzoate Openeye Name: methyl 4-[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxo-ethoxy]-3-methoxy-benzoate CAS Name: 4-[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxoethoxy]-3-methoxybenzoic acid methyl ester IUPAC Name: methyl 4-[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-oxoethoxy]-3-methoxybenzoate Traditional Name: 4-[2-[[(1S)-1-(4-bromophenyl)propyl]amino]-2-keto-ethoxy]-3-methoxy-benzoic acid methyl ester Formula: C20H22BrNO5 MolecularWeight: 436.29638

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)Br)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)OC

Isomeric SMILES

CC[C@@H](C1=CC=C(C=C1)Br)NC(=O)COC2=C(C=C(C=C2)C(=O)OC)OC

InChI

InChI=1S/C20H22BrNO5/c1-4-16(13-5-8-15(21)9-6-13)22-19(23)12-27-17-10-7-14(20(24)26-3)11-18(17)25-2/h5-11,16H,4,12H2,1-3H3,(H,22,23)/t16-/m0/s1