4-chloranyl-N-[3-(2-methylpiperidin-1-yl)propyl]-3-nitro-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide

Systemtic Name: 4-chloranyl-N-[3-(2-methylpiperidin-1-yl)propyl]-3-nitro-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide Openeye Name: N-[(4-benzyloxyphenyl)methyl]-4-chloro-N-[3-(2-methyl-1-piperidyl)propyl]-3-nitro-benzenesulfonamide CAS Name: 4-chloro-N-[3-(2-methyl-1-piperidinyl)propyl]-3-nitro-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide IUPAC Name: 4-chloro-N-[3-(2-methylpiperidin-1-yl)propyl]-3-nitro-N-[(4-phenylmethoxyphenyl)methyl]benzenesulfonamide Traditional Name: N-(4-benzoxybenzyl)-4-chloro-N-[3-(2-methylpiperidino)propyl]-3-nitro-benzenesulfonamide Formula: C29H34ClN3O5S MolecularWeight: 572.11536

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCN(CC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1CCCN(CC2=CC=C(C=C2)OCC3=CC=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C29H34ClN3O5S/c1-23-8-5-6-17-31(23)18-7-19-32(39(36,37)27-15-16-28(30)29(20-27)33(34)35)21-24-11-13-26(14-12-24)38-22-25-9-3-2-4-10-25/h2-4,9-16,20,23H,5-8,17-19,21-22H2,1H3