4-chloranyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-pentyl-benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-pentyl-benzenesulfonamide Openeye Name: 4-chloro-3-nitro-N-[[1-(o-tolylmethyl)pyrrol-2-yl]methyl]-N-pentyl-benzenesulfonamide CAS Name: 4-chloro-N-[[1-[(2-methylphenyl)methyl]-2-pyrrolyl]methyl]-3-nitro-N-pentylbenzenesulfonamide IUPAC Name: 4-chloro-N-[[1-[(2-methylphenyl)methyl]pyrrol-2-yl]methyl]-3-nitro-N-pentylbenzenesulfonamide Traditional Name: N-amyl-4-chloro-N-[[1-(2-methylbenzyl)pyrrol-2-yl]methyl]-3-nitro-benzenesulfonamide Formula: C24H28ClN3O4S MolecularWeight: 490.01482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CC1=CC=CN1CC2=CC=CC=C2C)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

CCCCCN(CC1=CC=CN1CC2=CC=CC=C2C)S(=O)(=O)C3=CC(=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C24H28ClN3O4S/c1-3-4-7-15-27(33(31,32)22-12-13-23(25)24(16-22)28(29)30)18-21-11-8-14-26(21)17-20-10-6-5-9-19(20)2/h5-6,8-14,16H,3-4,7,15,17-18H2,1-2H3