N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-3-nitro-N-prop-2-ynyl-benzenesulfonamide

Systemtic Name: N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-3-nitro-N-prop-2-ynyl-benzenesulfonamide Openeye Name: N-indan-1-yl-4-methoxy-3-nitro-N-prop-2-ynyl-benzenesulfonamide CAS Name: N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-3-nitro-N-prop-2-ynylbenzenesulfonamide IUPAC Name: N-(2,3-dihydro-1H-inden-1-yl)-4-methoxy-3-nitro-N-prop-2-ynylbenzenesulfonamide Traditional Name: N-indan-1-yl-4-methoxy-3-nitro-N-propargyl-benzenesulfonamide Formula: C19H18N2O5S MolecularWeight: 386.42162

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N(CC#C)C2CCC3=CC=CC=C23)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N(CC#C)C2CCC3=CC=CC=C23)[N+](=O)[O-]

InChI

InChI=1S/C19H18N2O5S/c1-3-12-20(17-10-8-14-6-4-5-7-16(14)17)27(24,25)15-9-11-19(26-2)18(13-15)21(22)23/h1,4-7,9,11,13,17H,8,10,12H2,2H3