(Z)-6-[3-[(3-nitrophenyl)carbamoylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid

Systemtic Name: (Z)-6-[3-[(3-nitrophenyl)carbamoylamino]phenyl]-6-pyridin-3-yl-hex-5-enoic acid Openeye Name: (Z)-6-[3-[(3-nitrophenyl)carbamoylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid CAS Name: (Z)-6-[3-[[(3-nitroanilino)-oxomethyl]amino]phenyl]-6-(3-pyridinyl)-5-hexenoic acid IUPAC Name: (Z)-6-[3-[(3-nitrophenyl)carbamoylamino]phenyl]-6-pyridin-3-ylhex-5-enoic acid Traditional Name: (Z)-6-[3-[(3-nitrophenyl)carbamoylamino]phenyl]-6-(3-pyridyl)hex-5-enoic acid Formula: C24H22N4O5 MolecularWeight: 446.45528

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])C(=CCCCC(=O)O)C3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NC2=CC(=CC=C2)[N+](=O)[O-])/C(=C/CCCC(=O)O)/C3=CN=CC=C3

InChI

InChI=1S/C24H22N4O5/c29-23(30)12-2-1-11-22(18-7-5-13-25-16-18)17-6-3-8-19(14-17)26-24(31)27-20-9-4-10-21(15-20)28(32)33/h3-11,13-16H,1-2,12H2,(H,29,30)(H2,26,27,31)/b22-11-