ethyl (E)-2-[(2-bromophenyl)methyl]-5-cyano-2-[(E)-C-methyl-N-phenylmethoxy-carbonimidoyl]pent-4-enoate

Systemtic Name: ethyl (E)-2-[(2-bromophenyl)methyl]-5-cyano-2-[(E)-C-methyl-N-phenylmethoxy-carbonimidoyl]pent-4-enoate Openeye Name: ethyl (E)-2-[(E)-N-benzyloxy-C-methyl-carbonimidoyl]-2-[(2-bromophenyl)methyl]-5-cyano-pent-4-enoate CAS Name: (E)-2-[(2-bromophenyl)methyl]-5-cyano-2-[(1E)-1-phenylmethoxyiminoethyl]-4-pentenoic acid ethyl ester IUPAC Name: ethyl (E)-2-[(2-bromophenyl)methyl]-5-cyano-2-[(E)-C-methyl-N-phenylmethoxycarbonimidoyl]pent-4-enoate Traditional Name: (E)-2-[(E)-N-benzoxy-C-methyl-carbonimidoyl]-2-(2-bromobenzyl)-5-cyano-pent-4-enoic acid ethyl ester Formula: C24H25BrN2O3 MolecularWeight: 469.3709

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC=CC#N)(CC1=CC=CC=C1Br)C(=NOCC2=CC=CC=C2)C

Isomeric SMILES

CCOC(=O)C(C/C=C/C#N)(CC1=CC=CC=C1Br)/C(=N/OCC2=CC=CC=C2)/C

InChI

InChI=1S/C24H25BrN2O3/c1-3-29-23(28)24(15-9-10-16-26,17-21-13-7-8-14-22(21)25)19(2)27-30-18-20-11-5-4-6-12-20/h4-14H,3,15,17-18H2,1-2H3/b10-9+,27-19+