N-(2-ethylphenyl)-2-[4-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]piperazin-1-ium-1-yl]ethanamide

Systemtic Name: N-(2-ethylphenyl)-2-[4-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]piperazin-1-ium-1-yl]ethanamide Openeye Name: N-(2-ethylphenyl)-2-[4-[(E)-3-(2-methoxy-5-methyl-phenyl)prop-2-enoyl]piperazin-1-ium-1-yl]acetamide CAS Name: N-(2-ethylphenyl)-2-[4-[(E)-3-(2-methoxy-5-methylphenyl)-1-oxoprop-2-enyl]-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2-ethylphenyl)-2-[4-[(E)-3-(2-methoxy-5-methylphenyl)prop-2-enoyl]piperazin-1-ium-1-yl]acetamide Traditional Name: N-(2-ethylphenyl)-2-[4-[(E)-3-(2-methoxy-5-methyl-phenyl)acryloyl]piperazin-1-ium-1-yl]acetamide Formula: C25H32N3O3+ MolecularWeight: 422.53988

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)C=CC3=C(C=CC(=C3)C)OC

Isomeric SMILES

CCC1=CC=CC=C1NC(=O)C[NH+]2CCN(CC2)C(=O)/C=C/C3=C(C=CC(=C3)C)OC

InChI

InChI=1S/C25H31N3O3/c1-4-20-7-5-6-8-22(20)26-24(29)18-27-13-15-28(16-14-27)25(30)12-10-21-17-19(2)9-11-23(21)31-3/h5-12,17H,4,13-16,18H2,1-3H3,(H,26,29)/p+1/b12-10+