3-nitro-N-pentyl-4-pyrrolidin-1-yl-benzamide

Systemtic Name: 3-nitro-N-pentyl-4-pyrrolidin-1-yl-benzamide Openeye Name: 3-nitro-N-pentyl-4-pyrrolidin-1-yl-benzamide CAS Name: 3-nitro-N-pentyl-4-(1-pyrrolidinyl)benzamide IUPAC Name: 3-nitro-N-pentyl-4-pyrrolidin-1-ylbenzamide Traditional Name: N-amyl-3-nitro-4-pyrrolidino-benzamide Formula: C16H23N3O3 MolecularWeight: 305.37212

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

Isomeric SMILES

CCCCCNC(=O)C1=CC(=C(C=C1)N2CCCC2)[N+](=O)[O-]

InChI

InChI=1S/C16H23N3O3/c1-2-3-4-9-17-16(20)13-7-8-14(15(12-13)19(21)22)18-10-5-6-11-18/h7-8,12H,2-6,9-11H2,1H3,(H,17,20)