1-(3,5-dimethylpiperidin-1-yl)-2-[4-[(7-nitro-1H-indol-2-yl)carbonyl]piperazin-1-yl]ethanone

Systemtic Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[4-[(7-nitro-1H-indol-2-yl)carbonyl]piperazin-1-yl]ethanone Openeye Name: 1-(3,5-dimethyl-1-piperidyl)-2-[4-(7-nitro-1H-indole-2-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-(3,5-dimethyl-1-piperidinyl)-2-[4-[(7-nitro-1H-indol-2-yl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 1-(3,5-dimethylpiperidin-1-yl)-2-[4-(7-nitro-1H-indole-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-(3,5-dimethylpiperidino)-2-[4-(7-nitro-1H-indole-2-carbonyl)piperazino]ethanone Formula: C22H29N5O4 MolecularWeight: 427.49676

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC4=C(N3)C(=CC=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(CN(C1)C(=O)CN2CCN(CC2)C(=O)C3=CC4=C(N3)C(=CC=C4)[N+](=O)[O-])C

InChI

InChI=1S/C22H29N5O4/c1-15-10-16(2)13-26(12-15)20(28)14-24-6-8-25(9-7-24)22(29)18-11-17-4-3-5-19(27(30)31)21(17)23-18/h3-5,11,15-16,23H,6-10,12-14H2,1-2H3