(E)-N-[3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-3-phenyl-prop-2-enamide

Systemtic Name: (E)-N-[3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-oxidanylidene-propyl]-3-phenyl-prop-2-enamide Openeye Name: (E)-N-[3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-oxo-propyl]-3-phenyl-prop-2-enamide CAS Name: (E)-N-[3-[4-[(4-methoxyphenyl)methyl]-1-piperazin-4-iumyl]-3-oxopropyl]-3-phenyl-2-propenamide IUPAC Name: (E)-N-[3-[4-[(4-methoxyphenyl)methyl]piperazin-4-ium-1-yl]-3-oxopropyl]-3-phenylprop-2-enamide Traditional Name: (E)-N-[3-keto-3-(4-p-anisylpiperazin-4-ium-1-yl)propyl]-3-phenyl-acrylamide Formula: C24H30N3O3+ MolecularWeight: 408.5133

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)CCNC(=O)C=CC3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)CCNC(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C24H29N3O3/c1-30-22-10-7-21(8-11-22)19-26-15-17-27(18-16-26)24(29)13-14-25-23(28)12-9-20-5-3-2-4-6-20/h2-12H,13-19H2,1H3,(H,25,28)/p+1/b12-9+