N-butyl-2-[4-[4-(cyclopropylamino)-3-nitro-phenyl]carbonylpiperazin-1-yl]ethanamide

Systemtic Name: N-butyl-2-[4-[4-(cyclopropylamino)-3-nitro-phenyl]carbonylpiperazin-1-yl]ethanamide Openeye Name: N-butyl-2-[4-[4-(cyclopropylamino)-3-nitro-benzoyl]piperazin-1-yl]acetamide CAS Name: N-butyl-2-[4-[[4-(cyclopropylamino)-3-nitrophenyl]-oxomethyl]-1-piperazinyl]acetamide IUPAC Name: N-butyl-2-[4-[4-(cyclopropylamino)-3-nitrobenzoyl]piperazin-1-yl]acetamide Traditional Name: N-butyl-2-[4-[4-(cyclopropylamino)-3-nitro-benzoyl]piperazino]acetamide Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

Isomeric SMILES

CCCCNC(=O)CN1CCN(CC1)C(=O)C2=CC(=C(C=C2)NC3CC3)[N+](=O)[O-]

InChI

InChI=1S/C20H29N5O4/c1-2-3-8-21-19(26)14-23-9-11-24(12-10-23)20(27)15-4-7-17(22-16-5-6-16)18(13-15)25(28)29/h4,7,13,16,22H,2-3,5-6,8-12,14H2,1H3,(H,21,26)