N-[4-[5-(1,4-diazepan-1-ylcarbonyl)furan-2-yl]phenyl]-4-nitro-benzamide

Systemtic Name: N-[4-[5-(1,4-diazepan-1-ylcarbonyl)furan-2-yl]phenyl]-4-nitro-benzamide Openeye Name: N-[4-[5-(1,4-diazepane-1-carbonyl)-2-furyl]phenyl]-4-nitro-benzamide CAS Name: N-[4-[5-[1,4-diazepan-1-yl(oxo)methyl]-2-furanyl]phenyl]-4-nitrobenzamide IUPAC Name: N-[4-[5-(1,4-diazepane-1-carbonyl)furan-2-yl]phenyl]-4-nitrobenzamide Traditional Name: N-[4-[5-(1,4-diazepane-1-carbonyl)-2-furyl]phenyl]-4-nitro-benzamide Formula: C23H22N4O5 MolecularWeight: 434.44458

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(=O)C2=CC=C(O2)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CNCCN(C1)C(=O)C2=CC=C(O2)C3=CC=C(C=C3)NC(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H22N4O5/c28-22(17-4-8-19(9-5-17)27(30)31)25-18-6-2-16(3-7-18)20-10-11-21(32-20)23(29)26-14-1-12-24-13-15-26/h2-11,24H,1,12-15H2,(H,25,28)