2-methyl-4-(4-prop-2-enylpiperazin-4-ium-1-yl)benzaldehyde

Systemtic Name: 2-methyl-4-(4-prop-2-enylpiperazin-4-ium-1-yl)benzaldehyde Openeye Name: 4-(4-allylpiperazin-4-ium-1-yl)-2-methyl-benzaldehyde CAS Name: 2-methyl-4-(4-prop-2-enyl-1-piperazin-4-iumyl)benzaldehyde IUPAC Name: 2-methyl-4-(4-prop-2-enylpiperazin-4-ium-1-yl)benzaldehyde Traditional Name: 4-(4-allylpiperazin-4-ium-1-yl)-2-methyl-benzaldehyde Formula: C15H21N2O+ MolecularWeight: 245.34004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)N2CC[NH+](CC2)CC=C)C=O

Isomeric SMILES

CC1=C(C=CC(=C1)N2CC[NH+](CC2)CC=C)C=O

InChI

InChI=1S/C15H20N2O/c1-3-6-16-7-9-17(10-8-16)15-5-4-14(12-18)13(2)11-15/h3-5,11-12H,1,6-10H2,2H3/p+1