N-[2-[4-(furan-2-ylmethylcarbamoyl)phenyl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide

Systemtic Name: N-[2-[4-(furan-2-ylmethylcarbamoyl)phenyl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide Openeye Name: N-[2-[4-(2-furylmethylcarbamoyl)phenyl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide CAS Name: N-[2-[4-[(2-furanylmethylamino)-oxomethyl]phenyl]-5-methyl-3-pyrazolyl]-3-nitrobenzamide IUPAC Name: N-[2-[4-(furan-2-ylmethylcarbamoyl)phenyl]-5-methylpyrazol-3-yl]-3-nitrobenzamide Traditional Name: N-[2-[4-(2-furfurylcarbamoyl)phenyl]-5-methyl-pyrazol-3-yl]-3-nitro-benzamide Formula: C23H19N5O5 MolecularWeight: 445.42746

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)NCC4=CC=CO4

Isomeric SMILES

CC1=NN(C(=C1)NC(=O)C2=CC(=CC=C2)[N+](=O)[O-])C3=CC=C(C=C3)C(=O)NCC4=CC=CO4

InChI

InChI=1S/C23H19N5O5/c1-15-12-21(25-23(30)17-4-2-5-19(13-17)28(31)32)27(26-15)18-9-7-16(8-10-18)22(29)24-14-20-6-3-11-33-20/h2-13H,14H2,1H3,(H,24,29)(H,25,30)