methyl 2-[[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl 2-[[6,8-bis(bromanyl)-2-oxidanylidene-chromen-3-yl]carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl 2-[(6,8-dibromo-2-oxo-chromene-3-carbonyl)amino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[[(6,8-dibromo-2-oxo-1-benzopyran-3-yl)-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl 2-[(6,8-dibromo-2-oxochromene-3-carbonyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(6,8-dibromo-2-keto-chromene-3-carbonyl)amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C22H16Br2N2O5 MolecularWeight: 548.18084

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=CC(=CC(=C4OC3=O)Br)Br

Isomeric SMILES

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=CC(=CC(=C4OC3=O)Br)Br

InChI

InChI=1S/C22H16Br2N2O5/c1-30-22(29)18(8-12-10-25-17-5-3-2-4-14(12)17)26-20(27)15-7-11-6-13(23)9-16(24)19(11)31-21(15)28/h2-7,9-10,18,25H,8H2,1H3,(H,26,27)