3-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-N-[(3-nitrophenyl)methyl]aniline

Systemtic Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-N-[(3-nitrophenyl)methyl]aniline Openeye Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-N-[(3-nitrophenyl)methyl]aniline CAS Name: 3-[[4-(2,5-dimethylphenyl)-1-piperazinyl]methyl]-N-[(3-nitrophenyl)methyl]aniline IUPAC Name: 3-[[4-(2,5-dimethylphenyl)piperazin-1-yl]methyl]-N-[(3-nitrophenyl)methyl]aniline Traditional Name: [3-[[4-(2,5-dimethylphenyl)piperazino]methyl]phenyl]-(3-nitrobenzyl)amine Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=CC(=CC=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)CC3=CC(=CC=C3)NCC4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C26H30N4O2/c1-20-9-10-21(2)26(15-20)29-13-11-28(12-14-29)19-23-6-3-7-24(16-23)27-18-22-5-4-8-25(17-22)30(31)32/h3-10,15-17,27H,11-14,18-19H2,1-2H3