diethyl-[[2-methoxy-5-[(E)-3-(4-methoxycarbonylphenyl)prop-2-enoyl]phenyl]methyl]azanium

Systemtic Name: diethyl-[[2-methoxy-5-[(E)-3-(4-methoxycarbonylphenyl)prop-2-enoyl]phenyl]methyl]azanium Openeye Name: diethyl-[[2-methoxy-5-[(E)-3-(4-methoxycarbonylphenyl)prop-2-enoyl]phenyl]methyl]ammonium CAS Name: diethyl-[[2-methoxy-5-[(E)-3-(4-methoxycarbonylphenyl)-1-oxoprop-2-enyl]phenyl]methyl]ammonium IUPAC Name: diethyl-[[2-methoxy-5-[(E)-3-(4-methoxycarbonylphenyl)prop-2-enoyl]phenyl]methyl]azanium Traditional Name: [5-[(E)-3-(4-carbomethoxyphenyl)acryloyl]-2-methoxy-benzyl]-diethyl-ammonium Formula: C23H28NO4+ MolecularWeight: 382.47272

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC(=C1)C(=O)C=CC2=CC=C(C=C2)C(=O)OC)OC

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC(=C1)C(=O)/C=C/C2=CC=C(C=C2)C(=O)OC)OC

InChI

InChI=1S/C23H27NO4/c1-5-24(6-2)16-20-15-19(12-14-22(20)27-3)21(25)13-9-17-7-10-18(11-8-17)23(26)28-4/h7-15H,5-6,16H2,1-4H3/p+1/b13-9+