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

Systemtic Name: 4-chloranyl-3-nitro-N-[[1-(phenylmethyl)pyrrol-2-yl]methyl]-N-propan-2-yl-benzenesulfonamide Openeye Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-chloro-N-isopropyl-3-nitro-benzenesulfonamide CAS Name: 4-chloro-3-nitro-N-[[1-(phenylmethyl)-2-pyrrolyl]methyl]-N-propan-2-ylbenzenesulfonamide IUPAC Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-chloro-3-nitro-N-propan-2-ylbenzenesulfonamide Traditional Name: N-[(1-benzylpyrrol-2-yl)methyl]-4-chloro-N-isopropyl-3-nitro-benzenesulfonamide Formula: C21H22ClN3O4S MolecularWeight: 447.93508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22ClN3O4S/c1-16(2)24(30(28,29)19-10-11-20(22)21(13-19)25(26)27)15-18-9-6-12-23(18)14-17-7-4-3-5-8-17/h3-13,16H,14-15H2,1-2H3