methyl 2-acetamido-3-[2-[bis[3-(2-acetamido-3-methoxy-3-oxidanylidene-propyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]propanoate

Systemtic Name: methyl 2-acetamido-3-[2-[bis[3-(2-acetamido-3-methoxy-3-oxidanylidene-propyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]propanoate Openeye Name: methyl 2-acetamido-3-[2-[bis[3-(2-acetamido-3-methoxy-3-oxo-propyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]propanoate CAS Name: 2-acetamido-3-[2-[bis[3-(2-acetamido-3-methoxy-3-oxopropyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]propanoic acid methyl ester IUPAC Name: methyl 2-acetamido-3-[2-[bis[3-(2-acetamido-3-methoxy-3-oxopropyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]propanoate Traditional Name: 2-acetamido-3-[2-[bis[3-(2-acetamido-3-keto-3-methoxy-propyl)-1H-indol-2-yl]methyl]-1H-indol-3-yl]propionic acid methyl ester Formula: C43H46N6O9 MolecularWeight: 790.86014

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC1=C(NC2=CC=CC=C21)C(C3=C(C4=CC=CC=C4N3)CC(C(=O)OC)NC(=O)C)C5=C(C6=CC=CC=C6N5)CC(C(=O)OC)NC(=O)C)C(=O)OC

Isomeric SMILES

CC(=O)NC(CC1=C(NC2=CC=CC=C21)C(C3=C(C4=CC=CC=C4N3)CC(C(=O)OC)NC(=O)C)C5=C(C6=CC=CC=C6N5)CC(C(=O)OC)NC(=O)C)C(=O)OC

InChI

InChI=1S/C43H46N6O9/c1-22(50)44-34(41(53)56-4)19-28-25-13-7-10-16-31(25)47-38(28)37(39-29(26-14-8-11-17-32(26)48-39)20-35(42(54)57-5)45-23(2)51)40-30(27-15-9-12-18-33(27)49-40)21-36(43(55)58-6)46-24(3)52/h7-18,34-37,47-49H,19-21H2,1-6H3,(H,44,50)(H,45,51)(H,46,52)