1-[4-[3-(2-methylpiperidin-1-yl)propylamino]-3-nitro-phenyl]piperidine-2,6-dione

Systemtic Name: 1-[4-[3-(2-methylpiperidin-1-yl)propylamino]-3-nitro-phenyl]piperidine-2,6-dione Openeye Name: 1-[4-[3-(2-methyl-1-piperidyl)propylamino]-3-nitro-phenyl]piperidine-2,6-dione CAS Name: 1-[4-[3-(2-methyl-1-piperidinyl)propylamino]-3-nitrophenyl]piperidine-2,6-dione IUPAC Name: 1-[4-[3-(2-methylpiperidin-1-yl)propylamino]-3-nitrophenyl]piperidine-2,6-dione Traditional Name: 1-[4-[3-(2-methylpiperidino)propylamino]-3-nitro-phenyl]piperidine-2,6-quinone Formula: C20H28N4O4 MolecularWeight: 388.46072

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1CCCNC2=C(C=C(C=C2)N3C(=O)CCCC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1CCCCN1CCCNC2=C(C=C(C=C2)N3C(=O)CCCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C20H28N4O4/c1-15-6-2-3-12-22(15)13-5-11-21-17-10-9-16(14-18(17)24(27)28)23-19(25)7-4-8-20(23)26/h9-10,14-15,21H,2-8,11-13H2,1H3