4-iodanyl-3-nitro-piperidine; 2-(1-phenylazanylpropyl)benzamide

Systemtic Name: 4-iodanyl-3-nitro-piperidine; 2-(1-phenylazanylpropyl)benzamide Openeye Name: 2-(1-anilinopropyl)benzamide; 4-iodo-3-nitro-piperidine CAS Name: 2-(1-anilinopropyl)benzamide; 4-iodo-3-nitropiperidine IUPAC Name: 2-(1-anilinopropyl)benzamide; 4-iodo-3-nitropiperidine Traditional Name: 2-(1-anilinopropyl)benzamide; 4-iodo-3-nitro-piperidine Formula: C21H27IN4O3 MolecularWeight: 510.36855

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1C(=O)N)NC2=CC=CC=C2.C1CNCC(C1I)[N+](=O)[O-]

Isomeric SMILES

CCC(C1=CC=CC=C1C(=O)N)NC2=CC=CC=C2.C1CNCC(C1I)[N+](=O)[O-]

InChI

InChI=1S/C16H18N2O.C5H9IN2O2/c1-2-15(18-12-8-4-3-5-9-12)13-10-6-7-11-14(13)16(17)19;6-4-1-2-7-3-5(4)8(9)10/h3-11,15,18H,2H2,1H3,(H2,17,19);4-5,7H,1-3H2