2-nitro-5-piperazin-1-yl-N-[[4-(propan-2-ylamino)phenyl]methyl]aniline

Systemtic Name: 2-nitro-5-piperazin-1-yl-N-[[4-(propan-2-ylamino)phenyl]methyl]aniline Openeye Name: N-[[4-(isopropylamino)phenyl]methyl]-2-nitro-5-piperazin-1-yl-aniline CAS Name: 2-nitro-5-(1-piperazinyl)-N-[[4-(propan-2-ylamino)phenyl]methyl]aniline IUPAC Name: 2-nitro-5-piperazin-1-yl-N-[[4-(propan-2-ylamino)phenyl]methyl]aniline Traditional Name: isopropyl-[4-[(2-nitro-5-piperazino-anilino)methyl]phenyl]amine Formula: C20H27N5O2 MolecularWeight: 369.46068

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC1=CC=C(C=C1)CNC2=C(C=CC(=C2)N3CCNCC3)[N+](=O)[O-]

InChI

InChI=1S/C20H27N5O2/c1-15(2)23-17-5-3-16(4-6-17)14-22-19-13-18(7-8-20(19)25(26)27)24-11-9-21-10-12-24/h3-8,13,15,21-23H,9-12,14H2,1-2H3