(2S)-3-(1H-indol-3-yl)-2-[[(2R)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]amino]propanoic acid

Systemtic Name: (2S)-3-(1H-indol-3-yl)-2-[[(2R)-4-methyl-1-oxidanylidene-1-phenylmethoxy-pentan-2-yl]amino]propanoic acid Openeye Name: (2S)-2-[[(1R)-1-benzyloxycarbonyl-3-methyl-butyl]amino]-3-(1H-indol-3-yl)propanoic acid CAS Name: (2S)-3-(1H-indol-3-yl)-2-[[(2R)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]propanoic acid IUPAC Name: (2S)-3-(1H-indol-3-yl)-2-[[(2R)-4-methyl-1-oxo-1-phenylmethoxypentan-2-yl]amino]propanoic acid Traditional Name: (2S)-2-[[(1R)-1-carbobenzoxy-3-methyl-butyl]amino]-3-(1H-indol-3-yl)propionic acid Formula: C24H28N2O4 MolecularWeight: 408.49012

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OCC1=CC=CC=C1)NC(CC2=CNC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)C[C@H](C(=O)OCC1=CC=CC=C1)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C24H28N2O4/c1-16(2)12-22(24(29)30-15-17-8-4-3-5-9-17)26-21(23(27)28)13-18-14-25-20-11-7-6-10-19(18)20/h3-11,14,16,21-22,25-26H,12-13,15H2,1-2H3,(H,27,28)/t21-,22+/m0/s1