4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide

Systemtic Name: 4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide Openeye Name: 4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide CAS Name: 4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-N-phenylbenzenesulfonamide IUPAC Name: 4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-N-phenylbenzenesulfonamide Traditional Name: 4-[2-(4-methoxyphenyl)ethylamino]-3-nitro-N-phenyl-benzenesulfonamide Formula: C21H21N3O5S MolecularWeight: 427.47354

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)CCNC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O5S/c1-29-18-9-7-16(8-10-18)13-14-22-20-12-11-19(15-21(20)24(25)26)30(27,28)23-17-5-3-2-4-6-17/h2-12,15,22-23H,13-14H2,1H3