[2-(methylamino)-5-nitro-phenyl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone

Systemtic Name: [2-(methylamino)-5-nitro-phenyl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Openeye Name: [2-(methylamino)-5-nitro-phenyl]-[4-(8-quinolylmethyl)piperazin-1-yl]methanone CAS Name: [2-(methylamino)-5-nitrophenyl]-[4-(8-quinolinylmethyl)-1-piperazinyl]methanone IUPAC Name: [2-(methylamino)-5-nitrophenyl]-[4-(quinolin-8-ylmethyl)piperazin-1-yl]methanone Traditional Name: [2-(methylamino)-5-nitro-phenyl]-[4-(8-quinolylmethyl)piperazino]methanone Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)N2CCN(CC2)CC3=CC=CC4=C3N=CC=C4

InChI

InChI=1S/C22H23N5O3/c1-23-20-8-7-18(27(29)30)14-19(20)22(28)26-12-10-25(11-13-26)15-17-5-2-4-16-6-3-9-24-21(16)17/h2-9,14,23H,10-13,15H2,1H3