2-[[4-methoxy-3-[(4-phenylmethoxyphenyl)methylcarbamoyl]phenyl]methyl]butanoic acid

Systemtic Name: 2-[[4-methoxy-3-[(4-phenylmethoxyphenyl)methylcarbamoyl]phenyl]methyl]butanoic acid Openeye Name: 2-[[3-[(4-benzyloxyphenyl)methylcarbamoyl]-4-methoxy-phenyl]methyl]butanoic acid CAS Name: 2-[[4-methoxy-3-[oxo-[(4-phenylmethoxyphenyl)methylamino]methyl]phenyl]methyl]butanoic acid IUPAC Name: 2-[[4-methoxy-3-[(4-phenylmethoxyphenyl)methylcarbamoyl]phenyl]methyl]butanoic acid Traditional Name: 2-[3-[(4-benzoxybenzyl)carbamoyl]-4-methoxy-benzyl]butyric acid Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCC(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C27H29NO5/c1-3-22(27(30)31)15-21-11-14-25(32-2)24(16-21)26(29)28-17-19-9-12-23(13-10-19)33-18-20-7-5-4-6-8-20/h4-14,16,22H,3,15,17-18H2,1-2H3,(H,28,29)(H,30,31)