N-[3-azanyl-1-[3-nitro-4-(pyridin-2-ylmethylamino)phenyl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: N-[3-azanyl-1-[3-nitro-4-(pyridin-2-ylmethylamino)phenyl]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-amino-1-[3-nitro-4-(2-pyridylmethylamino)phenyl]-3-oxo-propyl]benzamide CAS Name: N-[3-amino-1-[3-nitro-4-(2-pyridinylmethylamino)phenyl]-3-oxopropyl]benzamide IUPAC Name: N-[3-amino-1-[3-nitro-4-(pyridin-2-ylmethylamino)phenyl]-3-oxopropyl]benzamide Traditional Name: N-[3-amino-3-keto-1-[3-nitro-4-(2-pyridylmethylamino)phenyl]propyl]benzamide Formula: C22H21N5O4 MolecularWeight: 419.43324

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(CC(=O)N)C2=CC(=C(C=C2)NCC3=CC=CC=N3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC(CC(=O)N)C2=CC(=C(C=C2)NCC3=CC=CC=N3)[N+](=O)[O-]

InChI

InChI=1S/C22H21N5O4/c23-21(28)13-19(26-22(29)15-6-2-1-3-7-15)16-9-10-18(20(12-16)27(30)31)25-14-17-8-4-5-11-24-17/h1-12,19,25H,13-14H2,(H2,23,28)(H,26,29)