4-[4-(acetamidomethyl)naphthalen-1-yl]-3-(2,6-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid

Systemtic Name: 4-[4-(acetamidomethyl)naphthalen-1-yl]-3-(2,6-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Openeye Name: 4-[4-(acetamidomethyl)-1-naphthyl]-3-(2,6-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid CAS Name: 4-[4-(acetamidomethyl)-1-naphthalenyl]-3-(2,6-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid IUPAC Name: 4-[4-(acetamidomethyl)naphthalen-1-yl]-3-(2,6-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Traditional Name: 4-[4-(acetamidomethyl)-1-naphthyl]-3-(2,6-dimethoxyphenyl)-1H-pyrazole-5-carboxylic acid Formula: C25H23N3O5 MolecularWeight: 445.46722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCC1=CC=C(C2=CC=CC=C12)C3=C(NN=C3C4=C(C=CC=C4OC)OC)C(=O)O

Isomeric SMILES

CC(=O)NCC1=CC=C(C2=CC=CC=C12)C3=C(NN=C3C4=C(C=CC=C4OC)OC)C(=O)O

InChI

InChI=1S/C25H23N3O5/c1-14(29)26-13-15-11-12-18(17-8-5-4-7-16(15)17)21-23(27-28-24(21)25(30)31)22-19(32-2)9-6-10-20(22)33-3/h4-12H,13H2,1-3H3,(H,26,29)(H,27,28)(H,30,31)