N-(2-methylphenyl)-1,4-dipropyl-piperazine-2-carboxamide; nitric acid

Systemtic Name: N-(2-methylphenyl)-1,4-dipropyl-piperazine-2-carboxamide; nitric acid Openeye Name: nitric acid; N-(o-tolyl)-1,4-dipropyl-piperazine-2-carboxamide CAS Name: N-(2-methylphenyl)-1,4-dipropyl-2-piperazinecarboxamide; nitric acid IUPAC Name: N-(2-methylphenyl)-1,4-dipropylpiperazine-2-carboxamide; nitric acid Traditional Name: nitric acid; N-(o-tolyl)-1,4-dipropyl-piperazine-2-carboxamide Formula: C18H31N5O7 MolecularWeight: 429.46804

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1CCN(C(C1)C(=O)NC2=CC=CC=C2C)CCC.[N+](=O)(O)[O-].[N+](=O)(O)[O-]

Isomeric SMILES

CCCN1CCN(C(C1)C(=O)NC2=CC=CC=C2C)CCC.[N+](=O)(O)[O-].[N+](=O)(O)[O-]

InChI

InChI=1S/C18H29N3O.2HNO3/c1-4-10-20-12-13-21(11-5-2)17(14-20)18(22)19-16-9-7-6-8-15(16)3;2*2-1(3)4/h6-9,17H,4-5,10-14H2,1-3H3,(H,19,22);2*(H,2,3,4)