2-[2-[(3,4-didecoxyphenyl)carbamoyl]phenyl]benzoic acid

Systemtic Name: 2-[2-[(3,4-didecoxyphenyl)carbamoyl]phenyl]benzoic acid Openeye Name: 2-[2-[(3,4-didecoxyphenyl)carbamoyl]phenyl]benzoic acid CAS Name: 2-[2-[(3,4-didecoxyanilino)-oxomethyl]phenyl]benzoic acid IUPAC Name: 2-[2-[(3,4-didecoxyphenyl)carbamoyl]phenyl]benzoic acid Traditional Name: 2-[2-[(3,4-didecoxyphenyl)carbamoyl]phenyl]benzoic acid Formula: C40H55NO5 MolecularWeight: 629.8684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)O)OCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCOC1=C(C=C(C=C1)NC(=O)C2=CC=CC=C2C3=CC=CC=C3C(=O)O)OCCCCCCCCCC

InChI

InChI=1S/C40H55NO5/c1-3-5-7-9-11-13-15-21-29-45-37-28-27-32(31-38(37)46-30-22-16-14-12-10-8-6-4-2)41-39(42)35-25-19-17-23-33(35)34-24-18-20-26-36(34)40(43)44/h17-20,23-28,31H,3-16,21-22,29-30H2,1-2H3,(H,41,42)(H,43,44)