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

Systemtic Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-nitropyridin-2-yl)piperazin-1-yl]methanone hydrochloride Openeye Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-nitro-2-pyridyl)piperazin-1-yl]methanone hydrochloride CAS Name: (1,5-dimethyl-2-phenyl-3-indolyl)-[4-(5-nitro-2-pyridinyl)-1-piperazinyl]methanone hydrochloride IUPAC Name: (1,5-dimethyl-2-phenylindol-3-yl)-[4-(5-nitropyridin-2-yl)piperazin-1-yl]methanone hydrochloride Traditional Name: (1,5-dimethyl-2-phenyl-indol-3-yl)-[4-(5-nitro-2-pyridyl)piperazino]methanone hydrochloride Formula: C26H26ClN5O3 MolecularWeight: 491.96934

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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