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

Systemtic Name: 4-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-nitro-benzaldehyde Openeye Name: 4-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-nitro-benzaldehyde CAS Name: 4-[4-[1-(4-cyclohexylphenyl)ethyl]-1-piperazinyl]-3-nitrobenzaldehyde IUPAC Name: 4-[4-[1-(4-cyclohexylphenyl)ethyl]piperazin-1-yl]-3-nitrobenzaldehyde Traditional Name: 4-[4-[1-(4-cyclohexylphenyl)ethyl]piperazino]-3-nitro-benzaldehyde Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2CCCCC2)N3CCN(CC3)C4=C(C=C(C=C4)C=O)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)C2CCCCC2)N3CCN(CC3)C4=C(C=C(C=C4)C=O)[N+](=O)[O-]

InChI

InChI=1S/C25H31N3O3/c1-19(21-8-10-23(11-9-21)22-5-3-2-4-6-22)26-13-15-27(16-14-26)24-12-7-20(18-29)17-25(24)28(30)31/h7-12,17-19,22H,2-6,13-16H2,1H3