4-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-N-ethyl-2-nitro-aniline

Systemtic Name: 4-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-N-ethyl-2-nitro-aniline Openeye Name: 4-[(4-benzhydrylpiperazin-1-yl)methyl]-N-ethyl-2-nitro-aniline CAS Name: 4-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-N-ethyl-2-nitroaniline IUPAC Name: 4-[(4-benzhydrylpiperazin-1-yl)methyl]-N-ethyl-2-nitroaniline Traditional Name: [4-[(4-benzhydrylpiperazino)methyl]-2-nitro-phenyl]-ethyl-amine Formula: C26H30N4O2 MolecularWeight: 430.542

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(C=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CCNC1=C(C=C(C=C1)CN2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4)[N+](=O)[O-]

InChI

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