N,N-diethyl-4-[1-(4-methoxyphenyl)propylamino]-3-nitro-benzenesulfonamide

Systemtic Name: N,N-diethyl-4-[1-(4-methoxyphenyl)propylamino]-3-nitro-benzenesulfonamide Openeye Name: N,N-diethyl-4-[1-(4-methoxyphenyl)propylamino]-3-nitro-benzenesulfonamide CAS Name: N,N-diethyl-4-[1-(4-methoxyphenyl)propylamino]-3-nitrobenzenesulfonamide IUPAC Name: N,N-diethyl-4-[1-(4-methoxyphenyl)propylamino]-3-nitrobenzenesulfonamide Traditional Name: N,N-diethyl-4-[1-(4-methoxyphenyl)propylamino]-3-nitro-benzenesulfonamide Formula: C20H27N3O5S MolecularWeight: 421.51048

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)OC)NC2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=C(C=C1)OC)NC2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)[N+](=O)[O-]

InChI

InChI=1S/C20H27N3O5S/c1-5-18(15-8-10-16(28-4)11-9-15)21-19-13-12-17(14-20(19)23(24)25)29(26,27)22(6-2)7-3/h8-14,18,21H,5-7H2,1-4H3