3-[[4-(phenylcarbonyl)phenyl]carbamoyl]heptadecanoic acid

Systemtic Name: 3-[[4-(phenylcarbonyl)phenyl]carbamoyl]heptadecanoic acid Openeye Name: 3-[(4-benzoylphenyl)carbamoyl]heptadecanoic acid CAS Name: 3-[(4-benzoylanilino)-oxomethyl]heptadecanoic acid IUPAC Name: 3-[(4-benzoylphenyl)carbamoyl]heptadecanoic acid Traditional Name: 3-[(4-benzoylphenyl)carbamoyl]heptadecanoic acid Formula: C31H43NO4 MolecularWeight: 493.67742

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(CC(=O)O)C(=O)NC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCC(CC(=O)O)C(=O)NC1=CC=C(C=C1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C31H43NO4/c1-2-3-4-5-6-7-8-9-10-11-12-14-19-27(24-29(33)34)31(36)32-28-22-20-26(21-23-28)30(35)25-17-15-13-16-18-25/h13,15-18,20-23,27H,2-12,14,19,24H2,1H3,(H,32,36)(H,33,34)