4-(3,5-dimethylpyrazol-1-yl)-N-hexadecyl-benzamide

Systemtic Name: 4-(3,5-dimethylpyrazol-1-yl)-N-hexadecyl-benzamide Openeye Name: 4-(3,5-dimethylpyrazol-1-yl)-N-hexadecyl-benzamide CAS Name: 4-(3,5-dimethyl-1-pyrazolyl)-N-hexadecylbenzamide IUPAC Name: 4-(3,5-dimethylpyrazol-1-yl)-N-hexadecylbenzamide Traditional Name: N-cetyl-4-(3,5-dimethylpyrazol-1-yl)benzamide Formula: C28H45N3O MolecularWeight: 439.6764

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCNC(=O)C1=CC=C(C=C1)N2C(=CC(=N2)C)C

InChI

InChI=1S/C28H45N3O/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-22-29-28(32)26-18-20-27(21-19-26)31-25(3)23-24(2)30-31/h18-21,23H,4-17,22H2,1-3H3,(H,29,32)