4-[(3-piperazin-4-ium-1-ylcarbonylphenyl)methoxy]benzaldehyde

Systemtic Name: 4-[(3-piperazin-4-ium-1-ylcarbonylphenyl)methoxy]benzaldehyde Openeye Name: 4-[[3-(piperazin-4-ium-1-carbonyl)phenyl]methoxy]benzaldehyde CAS Name: 4-[[3-[oxo(1-piperazin-4-iumyl)methyl]phenyl]methoxy]benzaldehyde IUPAC Name: 4-[[3-(piperazin-4-ium-1-carbonyl)phenyl]methoxy]benzaldehyde Traditional Name: 4-[3-(piperazin-4-ium-1-carbonyl)benzyl]oxybenzaldehyde Formula: C19H21N2O3+ MolecularWeight: 325.38164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)C=O

Isomeric SMILES

C1CN(CC[NH2+]1)C(=O)C2=CC(=CC=C2)COC3=CC=C(C=C3)C=O

InChI

InChI=1S/C19H20N2O3/c22-13-15-4-6-18(7-5-15)24-14-16-2-1-3-17(12-16)19(23)21-10-8-20-9-11-21/h1-7,12-13,20H,8-11,14H2/p+1