2-[(4-heptoxyphenyl)carbamoyl]benzoic acid

Systemtic Name: 2-[(4-heptoxyphenyl)carbamoyl]benzoic acid Openeye Name: 2-[(4-heptoxyphenyl)carbamoyl]benzoic acid CAS Name: 2-[(4-heptoxyanilino)-oxomethyl]benzoic acid IUPAC Name: 2-[(4-heptoxyphenyl)carbamoyl]benzoic acid Traditional Name: 2-[(4-heptoxyphenyl)carbamoyl]benzoic acid Formula: C21H25NO4 MolecularWeight: 355.4275

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=O)C2=CC=CC=C2C(=O)O

InChI

InChI=1S/C21H25NO4/c1-2-3-4-5-8-15-26-17-13-11-16(12-14-17)22-20(23)18-9-6-7-10-19(18)21(24)25/h6-7,9-14H,2-5,8,15H2,1H3,(H,22,23)(H,24,25)