1-(3,5-dinitrophenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)urea

Systemtic Name: 1-(3,5-dinitrophenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)urea Openeye Name: 1-(3,5-dinitrophenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)urea CAS Name: 1-(3,5-dinitrophenyl)-3-[4-(1-pyrrolidinylsulfonyl)phenyl]urea IUPAC Name: 1-(3,5-dinitrophenyl)-3-(4-pyrrolidin-1-ylsulfonylphenyl)urea Traditional Name: 1-(3,5-dinitrophenyl)-3-(4-pyrrolidinosulfonylphenyl)urea Formula: C17H17N5O7S MolecularWeight: 435.41118

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC(=O)NC3=CC(=CC(=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C17H17N5O7S/c23-17(19-13-9-14(21(24)25)11-15(10-13)22(26)27)18-12-3-5-16(6-4-12)30(28,29)20-7-1-2-8-20/h3-6,9-11H,1-2,7-8H2,(H2,18,19,23)