[4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone

Systemtic Name: [4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone Openeye Name: [4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitro-phenyl)methanone CAS Name: [4-[(1-methyl-2-benzimidazolyl)methyl]-1-piperazinyl]-(2-methyl-3-nitrophenyl)methanone IUPAC Name: [4-[(1-methylbenzimidazol-2-yl)methyl]piperazin-1-yl]-(2-methyl-3-nitrophenyl)methanone Traditional Name: [4-[(1-methylbenzimidazol-2-yl)methyl]piperazino]-(2-methyl-3-nitro-phenyl)methanone Formula: C21H23N5O3 MolecularWeight: 393.43902

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3C

Isomeric SMILES

CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=NC4=CC=CC=C4N3C

InChI

InChI=1S/C21H23N5O3/c1-15-16(6-5-9-18(15)26(28)29)21(27)25-12-10-24(11-13-25)14-20-22-17-7-3-4-8-19(17)23(20)2/h3-9H,10-14H2,1-2H3