methyl (2S)-3-(1H-indol-3-yl)-2-[[4-oxidanylidene-4-(phenylmethoxyamino)-2-propan-2-yl-butanoyl]amino]propanoate

Systemtic Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[4-oxidanylidene-4-(phenylmethoxyamino)-2-propan-2-yl-butanoyl]amino]propanoate Openeye Name: methyl (2S)-2-[[4-(benzyloxyamino)-2-isopropyl-4-oxo-butanoyl]amino]-3-(1H-indol-3-yl)propanoate CAS Name: (2S)-2-[[1,4-dioxo-4-(phenylmethoxyamino)-2-propan-2-ylbutyl]amino]-3-(1H-indol-3-yl)propanoic acid methyl ester IUPAC Name: methyl (2S)-3-(1H-indol-3-yl)-2-[[4-oxo-4-(phenylmethoxyamino)-2-propan-2-ylbutanoyl]amino]propanoate Traditional Name: (2S)-2-[[4-(benzoxyamino)-2-isopropyl-4-keto-butanoyl]amino]-3-(1H-indol-3-yl)propionic acid methyl ester Formula: C26H31N3O5 MolecularWeight: 465.54144

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(=O)NOCC1=CC=CC=C1)C(=O)NC(CC2=CNC3=CC=CC=C32)C(=O)OC

Isomeric SMILES

CC(C)C(CC(=O)NOCC1=CC=CC=C1)C(=O)N[C@@H](CC2=CNC3=CC=CC=C32)C(=O)OC

InChI

InChI=1S/C26H31N3O5/c1-17(2)21(14-24(30)29-34-16-18-9-5-4-6-10-18)25(31)28-23(26(32)33-3)13-19-15-27-22-12-8-7-11-20(19)22/h4-12,15,17,21,23,27H,13-14,16H2,1-3H3,(H,28,31)(H,29,30)/t21?,23-/m0/s1