[3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-propyl] 2,6-dimethylbenzoate

Systemtic Name: [3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-propyl] 2,6-dimethylbenzoate Openeye Name: [3-[[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-2-oxo-propyl] 2,6-dimethylbenzoate CAS Name: 2,6-dimethylbenzoic acid [3-[[(2S)-4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxopropyl] ester IUPAC Name: [3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxopropyl] 2,6-dimethylbenzoate Traditional Name: 2,6-dimethylbenzoic acid [3-[[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-2-keto-propyl] ester Formula: C26H32N2O6 MolecularWeight: 468.54208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)C(=O)OCC(=O)CNC(=O)C(CC(C)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=CC=C1)C)C(=O)OCC(=O)CNC(=O)[C@H](CC(C)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H32N2O6/c1-17(2)13-22(28-26(32)34-15-20-11-6-5-7-12-20)24(30)27-14-21(29)16-33-25(31)23-18(3)9-8-10-19(23)4/h5-12,17,22H,13-16H2,1-4H3,(H,27,30)(H,28,32)/t22-/m0/s1