4-(7-pyridin-3-ylheptanoylamino)-5-[4-(pyridin-3-ylmethoxy)phenyl]pentanoic acid

Systemtic Name: 4-(7-pyridin-3-ylheptanoylamino)-5-[4-(pyridin-3-ylmethoxy)phenyl]pentanoic acid Openeye Name: 4-[7-(3-pyridyl)heptanoylamino]-5-[4-(3-pyridylmethoxy)phenyl]pentanoic acid CAS Name: 4-[[1-oxo-7-(3-pyridinyl)heptyl]amino]-5-[4-(3-pyridinylmethoxy)phenyl]pentanoic acid IUPAC Name: 4-(7-pyridin-3-ylheptanoylamino)-5-[4-(pyridin-3-ylmethoxy)phenyl]pentanoic acid Traditional Name: 4-[7-(3-pyridyl)heptanoylamino]-5-[4-(3-pyridylmethoxy)phenyl]valeric acid Formula: C29H35N3O4 MolecularWeight: 489.6059

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CCCCCCC(=O)NC(CCC(=O)O)CC2=CC=C(C=C2)OCC3=CN=CC=C3

Isomeric SMILES

C1=CC(=CN=C1)CCCCCCC(=O)NC(CCC(=O)O)CC2=CC=C(C=C2)OCC3=CN=CC=C3

InChI

InChI=1S/C29H35N3O4/c33-28(10-4-2-1-3-7-24-8-5-17-30-20-24)32-26(13-16-29(34)35)19-23-11-14-27(15-12-23)36-22-25-9-6-18-31-21-25/h5-6,8-9,11-12,14-15,17-18,20-21,26H,1-4,7,10,13,16,19,22H2,(H,32,33)(H,34,35)