3-chloranyl-4-methoxy-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)aniline

Systemtic Name: 3-chloranyl-4-methoxy-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)aniline Openeye Name: 3-chloro-4-methoxy-N-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)aniline CAS Name: 3-chloro-4-methoxy-N-[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]aniline IUPAC Name: 3-chloro-4-methoxy-N-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)aniline Traditional Name: (3-chloro-4-methoxy-phenyl)-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C17H18ClN3O5S MolecularWeight: 411.85992

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H18ClN3O5S/c1-26-17-7-4-12(10-14(17)18)19-15-6-5-13(11-16(15)21(22)23)27(24,25)20-8-2-3-9-20/h4-7,10-11,19H,2-3,8-9H2,1H3