4-(2-methoxyethylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitro-benzamide

Systemtic Name: 4-(2-methoxyethylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitro-benzamide Openeye Name: 4-(2-methoxyethylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitro-benzamide CAS Name: 4-(2-methoxyethylamino)-N-[2-(4-methyl-1-piperazinyl)phenyl]-3-nitrobenzamide IUPAC Name: 4-(2-methoxyethylamino)-N-[2-(4-methylpiperazin-1-yl)phenyl]-3-nitrobenzamide Traditional Name: 4-(2-methoxyethylamino)-N-[2-(4-methylpiperazino)phenyl]-3-nitro-benzamide Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC=C2NC(=O)C3=CC(=C(C=C3)NCCOC)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O4/c1-24-10-12-25(13-11-24)19-6-4-3-5-18(19)23-21(27)16-7-8-17(22-9-14-30-2)20(15-16)26(28)29/h3-8,15,22H,9-14H2,1-2H3,(H,23,27)