N-[(1-ethylpyrrolidin-2-yl)methyl]-1,4,5-trinitro-naphthalene-2-carboxamide

Systemtic Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-1,4,5-trinitro-naphthalene-2-carboxamide Openeye Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-1,4,5-trinitro-naphthalene-2-carboxamide CAS Name: N-[(1-ethyl-2-pyrrolidinyl)methyl]-1,4,5-trinitro-2-naphthalenecarboxamide IUPAC Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-1,4,5-trinitronaphthalene-2-carboxamide Traditional Name: N-[(1-ethylpyrrolidin-2-yl)methyl]-1,4,5-trinitro-2-naphthamide Formula: C18H19N5O7 MolecularWeight: 417.37276

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCCC1CNC(=O)C2=CC(=C3C(=C2[N+](=O)[O-])C=CC=C3[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN1CCCC1CNC(=O)C2=CC(=C3C(=C2[N+](=O)[O-])C=CC=C3[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O7/c1-2-20-8-4-5-11(20)10-19-18(24)13-9-15(22(27)28)16-12(17(13)23(29)30)6-3-7-14(16)21(25)26/h3,6-7,9,11H,2,4-5,8,10H2,1H3,(H,19,24)