N-(cyclopropylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide

Systemtic Name: N-(cyclopropylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Openeye Name: N-(cyclopropylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide CAS Name: N-(cyclopropylmethyl)-4-nitro-N-[3-(4-phenyl-1-piperazinyl)propyl]benzenesulfonamide IUPAC Name: N-(cyclopropylmethyl)-4-nitro-N-[3-(4-phenylpiperazin-1-yl)propyl]benzenesulfonamide Traditional Name: N-(cyclopropylmethyl)-4-nitro-N-[3-(4-phenylpiperazino)propyl]benzenesulfonamide Formula: C23H30N4O4S MolecularWeight: 458.5737

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1CN(CCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1CN(CCCN2CCN(CC2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O4S/c28-27(29)22-9-11-23(12-10-22)32(30,31)26(19-20-7-8-20)14-4-13-24-15-17-25(18-16-24)21-5-2-1-3-6-21/h1-3,5-6,9-12,20H,4,7-8,13-19H2