N-(2-methyl-1-phenyl-propyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline

Systemtic Name: N-(2-methyl-1-phenyl-propyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline Openeye Name: N-(2-methyl-1-phenyl-propyl)-2-nitro-4-pyrrolidin-1-ylsulfonyl-aniline CAS Name: N-(2-methyl-1-phenylpropyl)-2-nitro-4-(1-pyrrolidinylsulfonyl)aniline IUPAC Name: N-(2-methyl-1-phenylpropyl)-2-nitro-4-pyrrolidin-1-ylsulfonylaniline Traditional Name: (2-methyl-1-phenyl-propyl)-(2-nitro-4-pyrrolidinosulfonyl-phenyl)amine Formula: C20H25N3O4S MolecularWeight: 403.4952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H25N3O4S/c1-15(2)20(16-8-4-3-5-9-16)21-18-11-10-17(14-19(18)23(24)25)28(26,27)22-12-6-7-13-22/h3-5,8-11,14-15,20-21H,6-7,12-13H2,1-2H3