3-nitro-4-pyrrolidin-1-yl-N-(thiophen-2-ylmethyl)benzamide

Systemtic Name: 3-nitro-4-pyrrolidin-1-yl-N-(thiophen-2-ylmethyl)benzamide Openeye Name: 3-nitro-4-pyrrolidin-1-yl-N-(2-thienylmethyl)benzamide CAS Name: 3-nitro-4-(1-pyrrolidinyl)-N-(thiophen-2-ylmethyl)benzamide IUPAC Name: 3-nitro-4-pyrrolidin-1-yl-N-(thiophen-2-ylmethyl)benzamide Traditional Name: 3-nitro-4-pyrrolidino-N-(2-thenyl)benzamide Formula: C16H17N3O3S MolecularWeight: 331.38948

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=CS3)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)NCC3=CC=CS3)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O3S/c20-16(17-11-13-4-3-9-23-13)12-5-6-14(15(10-12)19(21)22)18-7-1-2-8-18/h3-6,9-10H,1-2,7-8,11H2,(H,17,20)