4-[4-(diphenylmethyl)piperazin-1-yl]-3-nitro-benzaldehyde

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-(4-benzhydrylpiperazin-1-yl)-3-nitro-benzaldehyde CAS Name: 4-[4-(diphenylmethyl)-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-(4-benzhydrylpiperazin-1-yl)-3-nitrobenzaldehyde Traditional Name: 4-(4-benzhydrylpiperazino)-3-nitro-benzaldehyde Formula: C24H23N3O3 MolecularWeight: 401.45772

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=C(C=C(C=C2)C=O)[N+](=O)[O-])C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3O3/c28-18-19-11-12-22(23(17-19)27(29)30)25-13-15-26(16-14-25)24(20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-12,17-18,24H,13-16H2