ethyl (5Z)-5-hydroxyimino-5-(4-methoxyphenyl)-2-[(E)-N'-oxidanylcarbamimidoyl]-3-phenyl-pentanoate

Systemtic Name: ethyl (5Z)-5-hydroxyimino-5-(4-methoxyphenyl)-2-[(E)-N'-oxidanylcarbamimidoyl]-3-phenyl-pentanoate Openeye Name: ethyl (5Z)-2-[(E)-N'-hydroxycarbamimidoyl]-5-hydroxyimino-5-(4-methoxyphenyl)-3-phenyl-pentanoate CAS Name: (5Z)-2-[(E)-amino(hydroxyimino)methyl]-5-hydroxyimino-5-(4-methoxyphenyl)-3-phenylpentanoic acid ethyl ester IUPAC Name: ethyl (5Z)-2-[(E)-N'-hydroxycarbamimidoyl]-5-hydroxyimino-5-(4-methoxyphenyl)-3-phenylpentanoate Traditional Name: (5Z)-2-[(E)-aminocarbohydroximoyl]-5-hydroximino-5-(4-methoxyphenyl)-3-phenyl-valeric acid ethyl ester Formula: C21H25N3O5 MolecularWeight: 399.4403

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(CC(=NO)C1=CC=C(C=C1)OC)C2=CC=CC=C2)C(=NO)N

Isomeric SMILES

CCOC(=O)C(C(C/C(=N/O)/C1=CC=C(C=C1)OC)C2=CC=CC=C2)/C(=N\O)/N

InChI

InChI=1S/C21H25N3O5/c1-3-29-21(25)19(20(22)24-27)17(14-7-5-4-6-8-14)13-18(23-26)15-9-11-16(28-2)12-10-15/h4-12,17,19,26-27H,3,13H2,1-2H3,(H2,22,24)/b23-18-