2-chloranyl-4-nitro-N-(phenylmethyl)-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]benzamide

Systemtic Name: 2-chloranyl-4-nitro-N-(phenylmethyl)-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]benzamide Openeye Name: N-benzyl-N-[(1-benzylpyrrol-2-yl)methyl]-2-chloro-4-nitro-benzamide CAS Name: 2-chloro-4-nitro-N-(phenylmethyl)-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]benzamide IUPAC Name: N-benzyl-N-[(1-benzylpyrrol-2-yl)methyl]-2-chloro-4-nitrobenzamide Traditional Name: N-benzyl-N-[(1-benzylpyrrol-2-yl)methyl]-2-chloro-4-nitro-benzamide Formula: C26H22ClN3O3 MolecularWeight: 459.92418

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)CN2C=CC=C2CN(CC3=CC=CC=C3)C(=O)C4=C(C=C(C=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C26H22ClN3O3/c27-25-16-22(30(32)33)13-14-24(25)26(31)29(18-21-10-5-2-6-11-21)19-23-12-7-15-28(23)17-20-8-3-1-4-9-20/h1-16H,17-19H2