2-[(2-nitrophenyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine

Systemtic Name: 2-[(2-nitrophenyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Openeye Name: 2-[(2-nitrophenyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine CAS Name: 2-[(2-nitrophenyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine IUPAC Name: 2-[(2-nitrophenyl)methyl]-3,4,5,6-tetrahydro-2H-azepin-7-amine Traditional Name: [2-(2-nitrobenzyl)-3,4,5,6-tetrahydro-2H-azepin-7-yl]amine Formula: C13H17N3O2 MolecularWeight: 247.29298

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC(C1)CC2=CC=CC=C2[N+](=O)[O-])N

Isomeric SMILES

C1CCC(=NC(C1)CC2=CC=CC=C2[N+](=O)[O-])N

InChI

InChI=1S/C13H17N3O2/c14-13-8-4-2-6-11(15-13)9-10-5-1-3-7-12(10)16(17)18/h1,3,5,7,11H,2,4,6,8-9H2,(H2,14,15)