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N-[3-(cyclopropylmethoxy)propyl]-4-methyl-3-nitro-benzenesulfonamide
N-[3-(cyclopropylmethoxy)propyl]-4-methyl-3-nitro-benzenesulfonamide
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Descriptors Computed from Structure
Canonical SMILES:
CC1=C(C=C(C=C1)S(=O)(=O)NCCCOCC2CC2)[N+](=O)[O-]
Isomeric SMILES
CC1=C(C=C(C=C1)S(=O)(=O)NCCCOCC2CC2)[N+](=O)[O-]
InChI
InChI=1S/C14H20N2O5S/c1-11-3-6-13(9-14(11)16(17)18)22(19,20)15-7-2-8-21-10-12-4-5-12/h3,6,9,12,15H,2,4-5,7-8,10H2,1H3
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