4-[4-[(3-nitrophenyl)carbonylamino]phenyl]butanoic acid

Systemtic Name: 4-[4-[(3-nitrophenyl)carbonylamino]phenyl]butanoic acid Openeye Name: 4-[4-[(3-nitrobenzoyl)amino]phenyl]butanoic acid CAS Name: 4-[4-[[(3-nitrophenyl)-oxomethyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-[(3-nitrobenzoyl)amino]phenyl]butanoic acid Traditional Name: 4-[4-[(3-nitrobenzoyl)amino]phenyl]butyric acid Formula: C17H16N2O5 MolecularWeight: 328.31934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CCCC(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)CCCC(=O)O

InChI

InChI=1S/C17H16N2O5/c20-16(21)6-1-3-12-7-9-14(10-8-12)18-17(22)13-4-2-5-15(11-13)19(23)24/h2,4-5,7-11H,1,3,6H2,(H,18,22)(H,20,21)