4-[2-[(4-ethoxy-3-methoxy-5-prop-2-enyl-phenyl)methylamino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(4-ethoxy-3-methoxy-5-prop-2-enyl-phenyl)methylamino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[(3-allyl-4-ethoxy-5-methoxy-phenyl)methylamino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(4-ethoxy-3-methoxy-5-prop-2-enylphenyl)methylamino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(4-ethoxy-3-methoxy-5-prop-2-enylphenyl)methylamino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[(3-allyl-4-ethoxy-5-methoxy-benzyl)amino]ethyl]benzenesulfonamide Formula: C21H28N2O4S MolecularWeight: 404.52302

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1OC)CNCCC2=CC=C(C=C2)S(=O)(=O)N)CC=C

Isomeric SMILES

CCOC1=C(C=C(C=C1OC)CNCCC2=CC=C(C=C2)S(=O)(=O)N)CC=C

InChI

InChI=1S/C21H28N2O4S/c1-4-6-18-13-17(14-20(26-3)21(18)27-5-2)15-23-12-11-16-7-9-19(10-8-16)28(22,24)25/h4,7-10,13-14,23H,1,5-6,11-12,15H2,2-3H3,(H2,22,24,25)