N-[(R)-cyclopropyl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide

Systemtic Name: N-[(R)-cyclopropyl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide Openeye Name: N-[(R)-cyclopropyl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitro-benzamide CAS Name: N-[(R)-cyclopropyl(phenyl)methyl]-4-(4-methyl-1-piperazinyl)-3-nitrobenzamide IUPAC Name: N-[(R)-cyclopropyl(phenyl)methyl]-4-(4-methylpiperazin-1-yl)-3-nitrobenzamide Traditional Name: N-[(R)-cyclopropyl(phenyl)methyl]-4-(4-methylpiperazino)-3-nitro-benzamide Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)NC(C3CC3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CN1CCN(CC1)C2=C(C=C(C=C2)C(=O)N[C@H](C3CC3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O3/c1-24-11-13-25(14-12-24)19-10-9-18(15-20(19)26(28)29)22(27)23-21(17-7-8-17)16-5-3-2-4-6-16/h2-6,9-10,15,17,21H,7-8,11-14H2,1H3,(H,23,27)/t21-/m0/s1