(4-nitrophenyl) 4-[2-(4-methylpyridin-2-yl)pyridin-4-yl]butanoate

Systemtic Name: (4-nitrophenyl) 4-[2-(4-methylpyridin-2-yl)pyridin-4-yl]butanoate Openeye Name: (4-nitrophenyl) 4-[2-(4-methyl-2-pyridyl)-4-pyridyl]butanoate CAS Name: 4-[2-(4-methyl-2-pyridinyl)-4-pyridinyl]butanoic acid (4-nitrophenyl) ester IUPAC Name: (4-nitrophenyl) 4-[2-(4-methylpyridin-2-yl)pyridin-4-yl]butanoate Traditional Name: 4-[2-(4-methyl-2-pyridyl)-4-pyridyl]butyric acid (4-nitrophenyl) ester Formula: C21H19N3O4 MolecularWeight: 377.39326

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC=C1)C2=NC=CC(=C2)CCCC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=NC=C1)C2=NC=CC(=C2)CCCC(=O)OC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H19N3O4/c1-15-9-11-22-19(13-15)20-14-16(10-12-23-20)3-2-4-21(25)28-18-7-5-17(6-8-18)24(26)27/h5-14H,2-4H2,1H3