N-[(5-chloranyl-1H-indol-3-yl)methyl]-3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide

Systemtic Name: N-[(5-chloranyl-1H-indol-3-yl)methyl]-3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Openeye Name: N-[(5-chloro-1H-indol-3-yl)methyl]-3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide CAS Name: N-[(5-chloro-1H-indol-3-yl)methyl]-3-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]benzamide IUPAC Name: N-[(5-chloro-1H-indol-3-yl)methyl]-3-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzamide Traditional Name: N-[(5-chloro-1H-indol-3-yl)methyl]-3-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzamide Formula: C22H20ClN5O3 MolecularWeight: 437.8789

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NCC3=CNC4=C3C=C(C=C4)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=CC(=C2)C(=O)NCC3=CNC4=C3C=C(C=C4)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C22H20ClN5O3/c1-13-21(28(30)31)14(2)27(26-13)12-15-4-3-5-16(8-15)22(29)25-11-17-10-24-20-7-6-18(23)9-19(17)20/h3-10,24H,11-12H2,1-2H3,(H,25,29)