2-(3-methyl-4-nitro-phenoxy)-5-pyrrolidin-1-ylsulfonyl-pyridine

Systemtic Name: 2-(3-methyl-4-nitro-phenoxy)-5-pyrrolidin-1-ylsulfonyl-pyridine Openeye Name: 2-(3-methyl-4-nitro-phenoxy)-5-pyrrolidin-1-ylsulfonyl-pyridine CAS Name: 2-(3-methyl-4-nitrophenoxy)-5-(1-pyrrolidinylsulfonyl)pyridine IUPAC Name: 2-(3-methyl-4-nitrophenoxy)-5-pyrrolidin-1-ylsulfonylpyridine Traditional Name: 2-(3-methyl-4-nitro-phenoxy)-5-pyrrolidinosulfonyl-pyridine Formula: C16H17N3O5S MolecularWeight: 363.38828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=CC(=C1)OC2=NC=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O5S/c1-12-10-13(4-6-15(12)19(20)21)24-16-7-5-14(11-17-16)25(22,23)18-8-2-3-9-18/h4-7,10-11H,2-3,8-9H2,1H3