(Z)-2-[3-(4-cyanophenyl)-5-methyl-1,2,4-triazol-4-yl]-3-naphthalen-1-yl-prop-2-enoic acid

Systemtic Name: (Z)-2-[3-(4-cyanophenyl)-5-methyl-1,2,4-triazol-4-yl]-3-naphthalen-1-yl-prop-2-enoic acid Openeye Name: (Z)-2-[3-(4-cyanophenyl)-5-methyl-1,2,4-triazol-4-yl]-3-(1-naphthyl)prop-2-enoic acid CAS Name: (Z)-2-[3-(4-cyanophenyl)-5-methyl-1,2,4-triazol-4-yl]-3-(1-naphthalenyl)-2-propenoic acid IUPAC Name: (Z)-2-[3-(4-cyanophenyl)-5-methyl-1,2,4-triazol-4-yl]-3-naphthalen-1-ylprop-2-enoic acid Traditional Name: (Z)-2-[3-(4-cyanophenyl)-5-methyl-1,2,4-triazol-4-yl]-3-(1-naphthyl)acrylic acid Formula: C23H16N4O2 MolecularWeight: 380.39874

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C(=CC2=CC=CC3=CC=CC=C32)C(=O)O)C4=CC=C(C=C4)C#N

Isomeric SMILES

CC1=NN=C(N1/C(=C\C2=CC=CC3=CC=CC=C32)/C(=O)O)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H16N4O2/c1-15-25-26-22(18-11-9-16(14-24)10-12-18)27(15)21(23(28)29)13-19-7-4-6-17-5-2-3-8-20(17)19/h2-13H,1H3,(H,28,29)/b21-13-