[3-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-propyl] 2-acetamido-6-chloranyl-benzoate

Systemtic Name: [3-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxidanylidene-propyl] 2-acetamido-6-chloranyl-benzoate Openeye Name: [3-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-2-oxo-propyl] 2-acetamido-6-chloro-benzoate CAS Name: 2-acetamido-6-chlorobenzoic acid [3-[[4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-2-oxopropyl] ester IUPAC Name: [3-[[4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-2-oxopropyl] 2-acetamido-6-chlorobenzoate Traditional Name: 2-acetamido-6-chloro-benzoic acid [3-[[2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-2-keto-propyl] ester Formula: C26H30ClN3O7 MolecularWeight: 531.9853

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NCC(=O)COC(=O)C1=C(C=CC=C1Cl)NC(=O)C)NC(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(C(=O)NCC(=O)COC(=O)C1=C(C=CC=C1Cl)NC(=O)C)NC(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C26H30ClN3O7/c1-16(2)12-22(30-26(35)37-14-18-8-5-4-6-9-18)24(33)28-13-19(32)15-36-25(34)23-20(27)10-7-11-21(23)29-17(3)31/h4-11,16,22H,12-15H2,1-3H3,(H,28,33)(H,29,31)(H,30,35)