2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(propan-2-ylcarbamoyl)benzoic acid

Systemtic Name: 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(propan-2-ylcarbamoyl)benzoic acid Openeye Name: 4-(isopropylcarbamoyl)-2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid CAS Name: 2-[[(E)-3-(2-naphthalenyl)-1-oxobut-2-enyl]amino]-4-[oxo-(propan-2-ylamino)methyl]benzoic acid IUPAC Name: 2-[[(E)-3-naphthalen-2-ylbut-2-enoyl]amino]-4-(propan-2-ylcarbamoyl)benzoic acid Traditional Name: 4-(isopropylcarbamoyl)-2-[[(E)-3-(2-naphthyl)but-2-enoyl]amino]benzoic acid Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=C(C=C1)C(=O)O)NC(=O)C=C(C)C2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)NC(=O)C1=CC(=C(C=C1)C(=O)O)NC(=O)/C=C(\C)/C2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C25H24N2O4/c1-15(2)26-24(29)20-10-11-21(25(30)31)22(14-20)27-23(28)12-16(3)18-9-8-17-6-4-5-7-19(17)13-18/h4-15H,1-3H3,(H,26,29)(H,27,28)(H,30,31)/b16-12+