[4-(2-methoxyethylamino)-3-nitro-phenyl]-[4-(3-methylphenyl)piperazin-1-yl]methanone

Systemtic Name: [4-(2-methoxyethylamino)-3-nitro-phenyl]-[4-(3-methylphenyl)piperazin-1-yl]methanone Openeye Name: [4-(2-methoxyethylamino)-3-nitro-phenyl]-[4-(m-tolyl)piperazin-1-yl]methanone CAS Name: [4-(2-methoxyethylamino)-3-nitrophenyl]-[4-(3-methylphenyl)-1-piperazinyl]methanone IUPAC Name: [4-(2-methoxyethylamino)-3-nitrophenyl]-[4-(3-methylphenyl)piperazin-1-yl]methanone Traditional Name: [4-(2-methoxyethylamino)-3-nitro-phenyl]-[4-(m-tolyl)piperazino]methanone Formula: C21H26N4O4 MolecularWeight: 398.45554

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=CC=C1)N2CCN(CC2)C(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C21H26N4O4/c1-16-4-3-5-18(14-16)23-9-11-24(12-10-23)21(26)17-6-7-19(22-8-13-29-2)20(15-17)25(27)28/h3-7,14-15,22H,8-13H2,1-2H3