3-[4-methoxy-3-[(3-naphthalen-1-ylprop-2-ynoylamino)methyl]phenyl]-2-propan-2-yloxy-propanoic acid

Systemtic Name: 3-[4-methoxy-3-[(3-naphthalen-1-ylprop-2-ynoylamino)methyl]phenyl]-2-propan-2-yloxy-propanoic acid Openeye Name: 2-isopropoxy-3-[4-methoxy-3-[[3-(1-naphthyl)prop-2-ynoylamino]methyl]phenyl]propanoic acid CAS Name: 3-[4-methoxy-3-[[[3-(1-naphthalenyl)-1-oxoprop-2-ynyl]amino]methyl]phenyl]-2-propan-2-yloxypropanoic acid IUPAC Name: 3-[4-methoxy-3-[(3-naphthalen-1-ylprop-2-ynoylamino)methyl]phenyl]-2-propan-2-yloxypropanoic acid Traditional Name: 2-isopropoxy-3-[4-methoxy-3-[[[3-(1-naphthyl)propioloyl]amino]methyl]phenyl]propionic acid Formula: C27H27NO5 MolecularWeight: 445.50698

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC(CC1=CC(=C(C=C1)OC)CNC(=O)C#CC2=CC=CC3=CC=CC=C32)C(=O)O

Isomeric SMILES

CC(C)OC(CC1=CC(=C(C=C1)OC)CNC(=O)C#CC2=CC=CC3=CC=CC=C32)C(=O)O

InChI

InChI=1S/C27H27NO5/c1-18(2)33-25(27(30)31)16-19-11-13-24(32-3)22(15-19)17-28-26(29)14-12-21-9-6-8-20-7-4-5-10-23(20)21/h4-11,13,15,18,25H,16-17H2,1-3H3,(H,28,29)(H,30,31)