4-methyl-2-[[2-oxidanyl-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[2-oxidanyl-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoyl]amino]pentanoic acid Openeye Name: 2-[[3-(benzyloxycarbonylamino)-2-hydroxy-4-(4-isopropoxyphenyl)butanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-hydroxy-1-oxo-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-hydroxy-3-(phenylmethoxycarbonylamino)-4-(4-propan-2-yloxyphenyl)butanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[3-(benzyloxycarbonylamino)-2-hydroxy-4-(4-isopropoxyphenyl)butanoyl]amino]-4-methyl-valeric acid Formula: C27H36N2O7 MolecularWeight: 500.58394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC=C(C=C1)OC(C)C)NC(=O)OCC2=CC=CC=C2)O

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(C(CC1=CC=C(C=C1)OC(C)C)NC(=O)OCC2=CC=CC=C2)O

InChI

InChI=1S/C27H36N2O7/c1-17(2)14-23(26(32)33)28-25(31)24(30)22(15-19-10-12-21(13-11-19)36-18(3)4)29-27(34)35-16-20-8-6-5-7-9-20/h5-13,17-18,22-24,30H,14-16H2,1-4H3,(H,28,31)(H,29,34)(H,32,33)