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

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

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

Isomeric SMILES

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

InChI

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