methyl (2S)-2-[(2-bromophenyl)methylideneamino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[(2-bromophenyl)methylideneamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[(2-bromophenyl)methyleneamino]-4-methyl-pentanoate CAS Name: (2S)-2-[(2-bromophenyl)methylideneamino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2-bromophenyl)methylideneamino]-4-methylpentanoate Traditional Name: (2S)-2-[(2-bromobenzylidene)amino]-4-methyl-valeric acid methyl ester Formula: C14H18BrNO2 MolecularWeight: 312.20222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)N=CC1=CC=CC=C1Br

Isomeric SMILES

CC(C)C[C@@H](C(=O)OC)N=CC1=CC=CC=C1Br

InChI

InChI=1S/C14H18BrNO2/c1-10(2)8-13(14(17)18-3)16-9-11-6-4-5-7-12(11)15/h4-7,9-10,13H,8H2,1-3H3/t13-/m0/s1