methyl (2S)-2-[(2,3-dipyridin-2-ylquinoxalin-6-yl)carbonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: methyl (2S)-2-[(2,3-dipyridin-2-ylquinoxalin-6-yl)carbonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: methyl (2S)-2-[[2,3-bis(2-pyridyl)quinoxaline-6-carbonyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[[2,3-bis(2-pyridinyl)-6-quinoxalinyl]-oxomethyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(2,3-dipyridin-2-ylquinoxaline-6-carbonyl)amino]-3-(1H-indol-3-yl)propanoate Traditional Name: (2S)-2-[[2,3-bis(2-pyridyl)quinoxaline-6-carbonyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C31H24N6O3 MolecularWeight: 528.56066

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N=C(C(=N4)C5=CC=CC=N5)C6=CC=CC=N6

Isomeric SMILES

COC(=O)[C@H](CC1=CNC2=CC=CC=C21)NC(=O)C3=CC4=C(C=C3)N=C(C(=N4)C5=CC=CC=N5)C6=CC=CC=N6

InChI

InChI=1S/C31H24N6O3/c1-40-31(39)27(17-20-18-34-22-9-3-2-8-21(20)22)37-30(38)19-12-13-23-26(16-19)36-29(25-11-5-7-15-33-25)28(35-23)24-10-4-6-14-32-24/h2-16,18,27,34H,17H2,1H3,(H,37,38)/t27-/m0/s1