4-[1-ethanoyl-7-[(4-nitrophenyl)methyl]indolizin-3-yl]carbonylbenzenecarbonitrile

Systemtic Name: 4-[1-ethanoyl-7-[(4-nitrophenyl)methyl]indolizin-3-yl]carbonylbenzenecarbonitrile Openeye Name: 4-[1-acetyl-7-[(4-nitrophenyl)methyl]indolizine-3-carbonyl]benzonitrile CAS Name: 4-[[1-acetyl-7-[(4-nitrophenyl)methyl]-3-indolizinyl]-oxomethyl]benzonitrile IUPAC Name: 4-[1-acetyl-7-[(4-nitrophenyl)methyl]indolizine-3-carbonyl]benzonitrile Traditional Name: 4-[1-acetyl-7-(4-nitrobenzyl)indolizine-3-carbonyl]benzonitrile Formula: C25H17N3O4 MolecularWeight: 423.42018

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C2C=C(C=CN2C(=C1)C(=O)C3=CC=C(C=C3)C#N)CC4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(=O)C1=C2C=C(C=CN2C(=C1)C(=O)C3=CC=C(C=C3)C#N)CC4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C25H17N3O4/c1-16(29)22-14-24(25(30)20-6-2-18(15-26)3-7-20)27-11-10-19(13-23(22)27)12-17-4-8-21(9-5-17)28(31)32/h2-11,13-14H,12H2,1H3