N-[2,4-dinitro-5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)phenyl]piperidin-1-amine

Systemtic Name: N-[2,4-dinitro-5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)phenyl]piperidin-1-amine Openeye Name: N-(2,4-dinitro-5-tetralin-5-yloxy-phenyl)piperidin-1-amine CAS Name: N-[2,4-dinitro-5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)phenyl]-1-piperidinamine IUPAC Name: N-[2,4-dinitro-5-(5,6,7,8-tetrahydronaphthalen-1-yloxy)phenyl]piperidin-1-amine Traditional Name: (2,4-dinitro-5-tetralin-5-yloxy-phenyl)-piperidino-amine Formula: C21H24N4O5 MolecularWeight: 412.43906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])OC3=CC=CC4=C3CCCC4

Isomeric SMILES

C1CCN(CC1)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])OC3=CC=CC4=C3CCCC4

InChI

InChI=1S/C21H24N4O5/c26-24(27)18-14-19(25(28)29)21(13-17(18)22-23-11-4-1-5-12-23)30-20-10-6-8-15-7-2-3-9-16(15)20/h6,8,10,13-14,22H,1-5,7,9,11-12H2