methyl (4S)-2-azanyl-6,8-bis(bromanyl)-4-[(1R)-1-cyano-2-methoxy-2-oxidanylidene-ethyl]-4H-chromene-3-carboxylate

Systemtic Name: methyl (4S)-2-azanyl-6,8-bis(bromanyl)-4-[(1R)-1-cyano-2-methoxy-2-oxidanylidene-ethyl]-4H-chromene-3-carboxylate Openeye Name: methyl (4S)-2-amino-6,8-dibromo-4-[(1R)-1-cyano-2-methoxy-2-oxo-ethyl]-4H-chromene-3-carboxylate CAS Name: (4S)-2-amino-6,8-dibromo-4-[(1R)-1-cyano-2-methoxy-2-oxoethyl]-4H-1-benzopyran-3-carboxylic acid methyl ester IUPAC Name: methyl (4S)-2-amino-6,8-dibromo-4-[(1R)-1-cyano-2-methoxy-2-oxoethyl]-4H-chromene-3-carboxylate Traditional Name: (4S)-2-amino-6,8-dibromo-4-[(1R)-1-cyano-2-keto-2-methoxy-ethyl]-4H-chromene-3-carboxylic acid methyl ester Formula: C15H12Br2N2O5 MolecularWeight: 460.07418

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(OC2=C(C=C(C=C2C1C(C#N)C(=O)OC)Br)Br)N

Isomeric SMILES

COC(=O)C1=C(OC2=C(C=C(C=C2[C@@H]1[C@H](C#N)C(=O)OC)Br)Br)N

InChI

InChI=1S/C15H12Br2N2O5/c1-22-14(20)8(5-18)10-7-3-6(16)4-9(17)12(7)24-13(19)11(10)15(21)23-2/h3-4,8,10H,19H2,1-2H3/t8-,10+/m0/s1