2-chloranyl-4-nitro-N-[2-(3-pyrazol-1-ylpropylcarbamoyl)phenyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-[2-(3-pyrazol-1-ylpropylcarbamoyl)phenyl]benzamide Openeye Name: 2-chloro-4-nitro-N-[2-(3-pyrazol-1-ylpropylcarbamoyl)phenyl]benzamide CAS Name: 2-chloro-4-nitro-N-[2-[oxo-[3-(1-pyrazolyl)propylamino]methyl]phenyl]benzamide IUPAC Name: 2-chloro-4-nitro-N-[2-(3-pyrazol-1-ylpropylcarbamoyl)phenyl]benzamide Traditional Name: 2-chloro-4-nitro-N-[2-(3-pyrazol-1-ylpropylcarbamoyl)phenyl]benzamide Formula: C20H18ClN5O4 MolecularWeight: 427.84102

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCN2C=CC=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCN2C=CC=N2)NC(=O)C3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H18ClN5O4/c21-17-13-14(26(29)30)7-8-15(17)20(28)24-18-6-2-1-5-16(18)19(27)22-9-3-11-25-12-4-10-23-25/h1-2,4-8,10,12-13H,3,9,11H2,(H,22,27)(H,24,28)