N,N-diethyl-4-[(E)-3-(5-nitrocyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperazine-1-carboxamide

Systemtic Name: N,N-diethyl-4-[(E)-3-(5-nitrocyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperazine-1-carboxamide Openeye Name: N,N-diethyl-4-[(E)-3-(5-nitrocyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperazine-1-carboxamide CAS Name: N,N-diethyl-4-[(E)-3-(5-nitro-1-cyclohexa-1,5-dienyl)-1-oxoprop-2-enyl]-1-piperazinecarboxamide IUPAC Name: N,N-diethyl-4-[(E)-3-(5-nitrocyclohexa-1,5-dien-1-yl)prop-2-enoyl]piperazine-1-carboxamide Traditional Name: N,N-diethyl-4-[(E)-3-(5-nitrocyclohexa-1,5-dien-1-yl)acryloyl]piperazine-1-carboxamide Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)N1CCN(CC1)C(=O)C=CC2=CCCC(=C2)[N+](=O)[O-]

Isomeric SMILES

CCN(CC)C(=O)N1CCN(CC1)C(=O)/C=C/C2=CCCC(=C2)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O4/c1-3-19(4-2)18(24)21-12-10-20(11-13-21)17(23)9-8-15-6-5-7-16(14-15)22(25)26/h6,8-9,14H,3-5,7,10-13H2,1-2H3/b9-8+