[(E)-1-[4-[(Z)-C-ethoxycarbonyl-N-methoxy-carbonimidoyl]phenyl]-2-phenyl-but-1-enyl]-dimethyl-phenoxy-azanium

Systemtic Name: [(E)-1-[4-[(Z)-C-ethoxycarbonyl-N-methoxy-carbonimidoyl]phenyl]-2-phenyl-but-1-enyl]-dimethyl-phenoxy-azanium Openeye Name: [(E)-1-[4-[(Z)-C-ethoxycarbonyl-N-methoxy-carbonimidoyl]phenyl]-2-phenyl-but-1-enyl]-dimethyl-phenoxy-ammonium CAS Name: [(E)-1-[4-[(1Z)-2-ethoxy-1-methoxyimino-2-oxoethyl]phenyl]-2-phenylbut-1-enyl]-dimethyl-phenoxyammonium IUPAC Name: [(E)-1-[4-[(Z)-C-ethoxycarbonyl-N-methoxycarbonimidoyl]phenyl]-2-phenylbut-1-enyl]-dimethyl-phenoxyazanium Traditional Name: [(E)-1-[4-[(Z)-C-carbethoxy-N-methoxy-carbonimidoyl]phenyl]-2-phenyl-but-1-enyl]-dimethyl-phenoxy-ammonium Formula: C29H33N2O4+ MolecularWeight: 473.58332

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C(C1=CC=C(C=C1)C(=NOC)C(=O)OCC)[N+](C)(C)OC2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC/C(=C(/C1=CC=C(C=C1)/C(=N/OC)/C(=O)OCC)\[N+](C)(C)OC2=CC=CC=C2)/C3=CC=CC=C3

InChI

InChI=1S/C29H33N2O4/c1-6-26(22-14-10-8-11-15-22)28(31(3,4)35-25-16-12-9-13-17-25)24-20-18-23(19-21-24)27(30-33-5)29(32)34-7-2/h8-21H,6-7H2,1-5H3/q+1/b28-26+,30-27-