N-[3-(cyclopropylmethoxy)propyl]-4-methylsulfonyl-2-nitro-aniline

Systemtic Name: N-[3-(cyclopropylmethoxy)propyl]-4-methylsulfonyl-2-nitro-aniline Openeye Name: N-[3-(cyclopropylmethoxy)propyl]-4-methylsulfonyl-2-nitro-aniline CAS Name: N-[3-(cyclopropylmethoxy)propyl]-4-methylsulfonyl-2-nitroaniline IUPAC Name: N-[3-(cyclopropylmethoxy)propyl]-4-methylsulfonyl-2-nitroaniline Traditional Name: 3-(cyclopropylmethoxy)propyl-(4-mesyl-2-nitro-phenyl)amine Formula: C14H20N2O5S MolecularWeight: 328.384

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)NCCCOCC2CC2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)NCCCOCC2CC2)[N+](=O)[O-]

InChI

InChI=1S/C14H20N2O5S/c1-22(19,20)12-5-6-13(14(9-12)16(17)18)15-7-2-8-21-10-11-3-4-11/h5-6,9,11,15H,2-4,7-8,10H2,1H3