N-[(E)-(2-methyl-3-pyridin-4-ylcarbonyl-indolizin-1-yl)methylideneamino]-4-nitro-benzamide

Systemtic Name: N-[(E)-(2-methyl-3-pyridin-4-ylcarbonyl-indolizin-1-yl)methylideneamino]-4-nitro-benzamide Openeye Name: N-[(E)-[2-methyl-3-(pyridine-4-carbonyl)indolizin-1-yl]methyleneamino]-4-nitro-benzamide CAS Name: N-[(E)-[2-methyl-3-[oxo(pyridin-4-yl)methyl]-1-indolizinyl]methylideneamino]-4-nitrobenzamide IUPAC Name: N-[(E)-[2-methyl-3-(pyridine-4-carbonyl)indolizin-1-yl]methylideneamino]-4-nitrobenzamide Traditional Name: N-[(E)-(3-isonicotinoyl-2-methyl-indolizin-1-yl)methyleneamino]-4-nitro-benzamide Formula: C23H17N5O4 MolecularWeight: 427.41218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N2C=CC=CC2=C1C=NNC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=NC=C4

Isomeric SMILES

CC1=C(N2C=CC=CC2=C1/C=N/NC(=O)C3=CC=C(C=C3)[N+](=O)[O-])C(=O)C4=CC=NC=C4

InChI

InChI=1S/C23H17N5O4/c1-15-19(14-25-26-23(30)17-5-7-18(8-6-17)28(31)32)20-4-2-3-13-27(20)21(15)22(29)16-9-11-24-12-10-16/h2-14H,1H3,(H,26,30)/b25-14+