2-[[4-methoxy-3-[(4-phenoxyphenyl)methylcarbamoyl]phenyl]methyl]pentanoic acid

Systemtic Name: 2-[[4-methoxy-3-[(4-phenoxyphenyl)methylcarbamoyl]phenyl]methyl]pentanoic acid Openeye Name: 2-[[4-methoxy-3-[(4-phenoxyphenyl)methylcarbamoyl]phenyl]methyl]pentanoic acid CAS Name: 2-[[4-methoxy-3-[oxo-[(4-phenoxyphenyl)methylamino]methyl]phenyl]methyl]pentanoic acid IUPAC Name: 2-[[4-methoxy-3-[(4-phenoxyphenyl)methylcarbamoyl]phenyl]methyl]pentanoic acid Traditional Name: 2-[4-methoxy-3-[(4-phenoxybenzyl)carbamoyl]benzyl]valeric acid Formula: C27H29NO5 MolecularWeight: 447.52286

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CCCC(CC1=CC(=C(C=C1)OC)C(=O)NCC2=CC=C(C=C2)OC3=CC=CC=C3)C(=O)O

InChI

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