(2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid

Systemtic Name: (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid Openeye Name: (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid CAS Name: (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-[[9H-fluoren-9-ylmethoxy(oxo)methyl]amino]propanoic acid IUPAC Name: (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propanoic acid Traditional Name: (2S)-3-(5,7-dimethyl-1H-indol-3-yl)-2-(9H-fluoren-9-ylmethoxycarbonylamino)propionic acid Formula: C28H26N2O4 MolecularWeight: 454.51704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C(=C1)C(=CN2)CC(C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C

Isomeric SMILES

CC1=CC(=C2C(=C1)C(=CN2)C[C@@H](C(=O)O)NC(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C

InChI

InChI=1S/C28H26N2O4/c1-16-11-17(2)26-23(12-16)18(14-29-26)13-25(27(31)32)30-28(33)34-15-24-21-9-5-3-7-19(21)20-8-4-6-10-22(20)24/h3-12,14,24-25,29H,13,15H2,1-2H3,(H,30,33)(H,31,32)/t25-/m0/s1