(2,3-dimethyl-1H-indol-5-yl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone

Systemtic Name: (2,3-dimethyl-1H-indol-5-yl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone Openeye Name: (2,3-dimethyl-1H-indol-5-yl)-[4-(6-nitro-3-pyridyl)piperazin-1-yl]methanone CAS Name: (2,3-dimethyl-1H-indol-5-yl)-[4-(6-nitro-3-pyridinyl)-1-piperazinyl]methanone IUPAC Name: (2,3-dimethyl-1H-indol-5-yl)-[4-(6-nitropyridin-3-yl)piperazin-1-yl]methanone Traditional Name: (2,3-dimethyl-1H-indol-5-yl)-[4-(6-nitro-3-pyridyl)piperazino]methanone Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-])C

Isomeric SMILES

CC1=C(NC2=C1C=C(C=C2)C(=O)N3CCN(CC3)C4=CN=C(C=C4)[N+](=O)[O-])C

InChI

InChI=1S/C20H21N5O3/c1-13-14(2)22-18-5-3-15(11-17(13)18)20(26)24-9-7-23(8-10-24)16-4-6-19(21-12-16)25(27)28/h3-6,11-12,22H,7-10H2,1-2H3