2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(3-oxidanylprop-1-ynyl)benzoic acid

Systemtic Name: 2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(3-oxidanylprop-1-ynyl)benzoic acid Openeye Name: 4-(3-hydroxyprop-1-ynyl)-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid CAS Name: 4-(3-hydroxyprop-1-ynyl)-2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 4-(3-hydroxyprop-1-ynyl)-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Traditional Name: 4-(3-hydroxyprop-1-ynyl)-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid Formula: C24H19NO4 MolecularWeight: 385.41196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)C#CCO)C(=O)O)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=CC(=C1)C#CCO)C(=O)O)/C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C24H19NO4/c1-16(19-10-9-18-6-2-3-7-20(18)15-19)13-23(27)25-22-14-17(5-4-12-26)8-11-21(22)24(28)29/h2-3,6-11,13-15,26H,12H2,1H3,(H,25,27)(H,28,29)/b16-13-