N-[(1R,2R)-2-(1-naphthalen-2-ylethylamino)cyclohexyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(1R,2R)-2-(1-naphthalen-2-ylethylamino)cyclohexyl]-4-nitro-benzenesulfonamide Openeye Name: N-[(1R,2R)-2-[1-(2-naphthyl)ethylamino]cyclohexyl]-4-nitro-benzenesulfonamide CAS Name: N-[(1R,2R)-2-[1-(2-naphthalenyl)ethylamino]cyclohexyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(1R,2R)-2-(1-naphthalen-2-ylethylamino)cyclohexyl]-4-nitrobenzenesulfonamide Traditional Name: N-[(1R,2R)-2-[1-(2-naphthyl)ethylamino]cyclohexyl]-4-nitro-benzenesulfonamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=CC=CC=C2C=C1)NC3CCCCC3NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC2=CC=CC=C2C=C1)N[C@@H]3CCCC[C@H]3NS(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C24H27N3O4S/c1-17(19-11-10-18-6-2-3-7-20(18)16-19)25-23-8-4-5-9-24(23)26-32(30,31)22-14-12-21(13-15-22)27(28)29/h2-3,6-7,10-17,23-26H,4-5,8-9H2,1H3/t17?,23-,24-/m1/s1