2-(4-phenylhepta-1,6-dien-4-ylcarbamoyl)benzoate

Systemtic Name: 2-(4-phenylhepta-1,6-dien-4-ylcarbamoyl)benzoate Openeye Name: 2-[(1-allyl-1-phenyl-but-3-enyl)carbamoyl]benzoate CAS Name: 2-[oxo-(4-phenylhepta-1,6-dien-4-ylamino)methyl]benzoate IUPAC Name: 2-(4-phenylhepta-1,6-dien-4-ylcarbamoyl)benzoate Traditional Name: 2-[(1-allyl-1-phenyl-but-3-enyl)carbamoyl]benzoate Formula: C21H20NO3- MolecularWeight: 334.3884

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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(CC=C)(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C=CCC(CC=C)(C1=CC=CC=C1)NC(=O)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C21H21NO3/c1-3-14-21(15-4-2,16-10-6-5-7-11-16)22-19(23)17-12-8-9-13-18(17)20(24)25/h3-13H,1-2,14-15H2,(H,22,23)(H,24,25)/p-1