5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1-(2-propoxyethyl)-4H-pyridine-3-carboxylic acid

Systemtic Name: 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1-(2-propoxyethyl)-4H-pyridine-3-carboxylic acid Openeye Name: 5-diisopropoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1-(2-propoxyethyl)-4H-pyridine-3-carboxylic acid CAS Name: 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1-(2-propoxyethyl)-4H-pyridine-3-carboxylic acid IUPAC Name: 5-di(propan-2-yloxy)phosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1-(2-propoxyethyl)-4H-pyridine-3-carboxylic acid Traditional Name: 5-diisopropoxyphosphoryl-2,6-dimethyl-4-(3-nitrophenyl)-1-(2-propoxyethyl)-4H-pyridine-3-carboxylic acid Formula: C25H37N2O8P MolecularWeight: 524.543641

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Descriptors Computed from Structure

Canonical SMILES:

CCCOCCN1C(=C(C(C(=C1C)P(=O)(OC(C)C)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C

Isomeric SMILES

CCCOCCN1C(=C(C(C(=C1C)P(=O)(OC(C)C)OC(C)C)C2=CC(=CC=C2)[N+](=O)[O-])C(=O)O)C

InChI

InChI=1S/C25H37N2O8P/c1-8-13-33-14-12-26-18(6)22(25(28)29)23(20-10-9-11-21(15-20)27(30)31)24(19(26)7)36(32,34-16(2)3)35-17(4)5/h9-11,15-17,23H,8,12-14H2,1-7H3,(H,28,29)