N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-benzamide

Systemtic Name: N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-benzamide Openeye Name: N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]-2-pyrrolyl]methyl]-4-methyl-3-nitrobenzamide IUPAC Name: N-butan-2-yl-N-[[1-[(3-chlorophenyl)methyl]pyrrol-2-yl]methyl]-4-methyl-3-nitrobenzamide Traditional Name: N-[[1-(3-chlorobenzyl)pyrrol-2-yl]methyl]-4-methyl-3-nitro-N-sec-butyl-benzamide Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCC(C)N(CC1=CC=CN1CC2=CC(=CC=C2)Cl)C(=O)C3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C24H26ClN3O3/c1-4-18(3)27(24(29)20-11-10-17(2)23(14-20)28(30)31)16-22-9-6-12-26(22)15-19-7-5-8-21(25)13-19/h5-14,18H,4,15-16H2,1-3H3