methyl (2S)-2-[(6-bromanyl-3,4-dihydro-2H-chromen-4-yl)amino]propanoate

Systemtic Name: methyl (2S)-2-[(6-bromanyl-3,4-dihydro-2H-chromen-4-yl)amino]propanoate Openeye Name: methyl (2S)-2-[(6-bromochroman-4-yl)amino]propanoate CAS Name: (2S)-2-[(6-bromo-3,4-dihydro-2H-1-benzopyran-4-yl)amino]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(6-bromo-3,4-dihydro-2H-chromen-4-yl)amino]propanoate Traditional Name: (2S)-2-[(6-bromochroman-4-yl)amino]propionic acid methyl ester Formula: C13H16BrNO3 MolecularWeight: 314.17504

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC1CCOC2=C1C=C(C=C2)Br

Isomeric SMILES

C[C@@H](C(=O)OC)NC1CCOC2=C1C=C(C=C2)Br

InChI

InChI=1S/C13H16BrNO3/c1-8(13(16)17-2)15-11-5-6-18-12-4-3-9(14)7-10(11)12/h3-4,7-8,11,15H,5-6H2,1-2H3/t8-,11?/m0/s1