[1,5-dimethyl-2-(4-nitrophenyl)indol-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone

Systemtic Name: [1,5-dimethyl-2-(4-nitrophenyl)indol-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Openeye Name: [1,5-dimethyl-2-(4-nitrophenyl)indol-3-yl]-[4-(2-pyridyl)piperazin-1-yl]methanone CAS Name: [1,5-dimethyl-2-(4-nitrophenyl)-3-indolyl]-[4-(2-pyridinyl)-1-piperazinyl]methanone IUPAC Name: [1,5-dimethyl-2-(4-nitrophenyl)indol-3-yl]-(4-pyridin-2-ylpiperazin-1-yl)methanone Traditional Name: [1,5-dimethyl-2-(4-nitrophenyl)indol-3-yl]-[4-(2-pyridyl)piperazino]methanone Formula: C26H25N5O3 MolecularWeight: 455.5084

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=C2C(=O)N3CCN(CC3)C4=CC=CC=N4)C5=CC=C(C=C5)[N+](=O)[O-])C

InChI

InChI=1S/C26H25N5O3/c1-18-6-11-22-21(17-18)24(25(28(22)2)19-7-9-20(10-8-19)31(33)34)26(32)30-15-13-29(14-16-30)23-5-3-4-12-27-23/h3-12,17H,13-16H2,1-2H3