[2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-[(2-bromophenyl)carbonylamino]-3-methyl-butanoate

Systemtic Name: [2-[(3-methoxyphenyl)methylamino]-2-oxidanylidene-ethyl] (2S)-2-[(2-bromophenyl)carbonylamino]-3-methyl-butanoate Openeye Name: [2-[(3-methoxyphenyl)methylamino]-2-oxo-ethyl] (2S)-2-[(2-bromobenzoyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(2-bromophenyl)-oxomethyl]amino]-3-methylbutanoic acid [2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(3-methoxyphenyl)methylamino]-2-oxoethyl] (2S)-2-[(2-bromobenzoyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(2-bromobenzoyl)amino]-3-methyl-butyric acid [2-keto-2-(m-anisylamino)ethyl] ester Formula: C22H25BrN2O5 MolecularWeight: 477.3483

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC(=O)NCC1=CC(=CC=C1)OC)NC(=O)C2=CC=CC=C2Br

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC(=O)NCC1=CC(=CC=C1)OC)NC(=O)C2=CC=CC=C2Br

InChI

InChI=1S/C22H25BrN2O5/c1-14(2)20(25-21(27)17-9-4-5-10-18(17)23)22(28)30-13-19(26)24-12-15-7-6-8-16(11-15)29-3/h4-11,14,20H,12-13H2,1-3H3,(H,24,26)(H,25,27)/t20-/m0/s1