4-(morpholin-4-ylcarbamoyl)-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid

Systemtic Name: 4-(morpholin-4-ylcarbamoyl)-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Openeye Name: 4-(morpholinocarbamoyl)-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid CAS Name: 4-[(4-morpholinylamino)-oxomethyl]-2-[[(Z)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]benzoic acid IUPAC Name: 4-(morpholin-4-ylcarbamoyl)-2-[[(Z)-3-naphthalen-2-ylbut-2-enoyl]amino]benzoic acid Traditional Name: 4-(morpholinocarbamoyl)-2-[[(Z)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid Formula: C26H25N3O5 MolecularWeight: 459.4938

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NC1=C(C=CC(=C1)C(=O)NN2CCOCC2)C(=O)O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C/C(=C/C(=O)NC1=C(C=CC(=C1)C(=O)NN2CCOCC2)C(=O)O)/C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C26H25N3O5/c1-17(19-7-6-18-4-2-3-5-20(18)15-19)14-24(30)27-23-16-21(8-9-22(23)26(32)33)25(31)28-29-10-12-34-13-11-29/h2-9,14-16H,10-13H2,1H3,(H,27,30)(H,28,31)(H,32,33)/b17-14-