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

Systemtic Name: methyl (2S)-2-acetamido-3-[2-[3-[(2S)-2-acetamido-3-methoxy-3-oxidanylidene-propyl]-1H-indol-2-yl]-1H-indol-3-yl]propanoate Openeye Name: methyl (2S)-2-acetamido-3-[2-[3-[(2S)-2-acetamido-3-methoxy-3-oxo-propyl]-1H-indol-2-yl]-1H-indol-3-yl]propanoate CAS Name: (2S)-2-acetamido-3-[2-[3-[(2S)-2-acetamido-3-methoxy-3-oxopropyl]-1H-indol-2-yl]-1H-indol-3-yl]propanoic acid methyl ester IUPAC Name: methyl (2S)-2-acetamido-3-[2-[3-[(2S)-2-acetamido-3-methoxy-3-oxopropyl]-1H-indol-2-yl]-1H-indol-3-yl]propanoate Traditional Name: (2S)-2-acetamido-3-[2-[3-[(2S)-2-acetamido-3-keto-3-methoxy-propyl]-1H-indol-2-yl]-1H-indol-3-yl]propionic acid methyl ester Formula: C28H30N4O6 MolecularWeight: 518.561

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(=O)N[C@@H](CC1=C(NC2=CC=CC=C21)C3=C(C4=CC=CC=C4N3)C[C@@H](C(=O)OC)NC(=O)C)C(=O)OC

InChI

InChI=1S/C28H30N4O6/c1-15(33)29-23(27(35)37-3)13-19-17-9-5-7-11-21(17)31-25(19)26-20(18-10-6-8-12-22(18)32-26)14-24(28(36)38-4)30-16(2)34/h5-12,23-24,31-32H,13-14H2,1-4H3,(H,29,33)(H,30,34)/t23-,24-/m0/s1