2-(2-chloranyl-4-phenyl-phenyl)-3-(2-methylpropylcarbamoylamino)-6-oxidanylidene-6-phenylmethoxy-hexanoic acid

Systemtic Name: 2-(2-chloranyl-4-phenyl-phenyl)-3-(2-methylpropylcarbamoylamino)-6-oxidanylidene-6-phenylmethoxy-hexanoic acid Openeye Name: 6-benzyloxy-2-(2-chloro-4-phenyl-phenyl)-3-(isobutylcarbamoylamino)-6-oxo-hexanoic acid CAS Name: 2-(2-chloro-4-phenylphenyl)-3-[[(2-methylpropylamino)-oxomethyl]amino]-6-oxo-6-phenylmethoxyhexanoic acid IUPAC Name: 2-(2-chloro-4-phenylphenyl)-3-(2-methylpropylcarbamoylamino)-6-oxo-6-phenylmethoxyhexanoic acid Traditional Name: 6-benzoxy-2-(2-chloro-4-phenyl-phenyl)-3-(isobutylcarbamoylamino)-6-keto-hexanoic acid Formula: C30H33ClN2O5 MolecularWeight: 537.04642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(CCC(=O)OCC1=CC=CC=C1)C(C2=C(C=C(C=C2)C3=CC=CC=C3)Cl)C(=O)O

Isomeric SMILES

CC(C)CNC(=O)NC(CCC(=O)OCC1=CC=CC=C1)C(C2=C(C=C(C=C2)C3=CC=CC=C3)Cl)C(=O)O

InChI

InChI=1S/C30H33ClN2O5/c1-20(2)18-32-30(37)33-26(15-16-27(34)38-19-21-9-5-3-6-10-21)28(29(35)36)24-14-13-23(17-25(24)31)22-11-7-4-8-12-22/h3-14,17,20,26,28H,15-16,18-19H2,1-2H3,(H,35,36)(H2,32,33,37)