methyl 1-[[(4E)-3-methyl-4-[(4-phenylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-yl]carbonyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[[(4E)-3-methyl-4-[(4-phenylphenyl)carbonylhydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-yl]carbonyl]piperidine-4-carboxylate Openeye Name: methyl 1-[(4E)-3-methyl-4-[(4-phenylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carbonyl]piperidine-4-carboxylate CAS Name: 1-[[(4E)-3-methyl-4-[[oxo-(4-phenylphenyl)methyl]hydrazinylidene]-6,7-dihydro-5H-benzofuran-2-yl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[(4E)-3-methyl-4-[(4-phenylbenzoyl)hydrazinylidene]-6,7-dihydro-5H-1-benzofuran-2-carbonyl]piperidine-4-carboxylate Traditional Name: 1-[(4E)-3-methyl-4-[(4-phenylbenzoyl)hydrazono]-6,7-dihydro-5H-benzofuran-2-carbonyl]isonipecotic acid methyl ester Formula: C30H31N3O5 MolecularWeight: 513.58424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C(=NNC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)CCC2)C(=O)N5CCC(CC5)C(=O)OC

Isomeric SMILES

CC1=C(OC2=C1/C(=N/NC(=O)C3=CC=C(C=C3)C4=CC=CC=C4)/CCC2)C(=O)N5CCC(CC5)C(=O)OC

InChI

InChI=1S/C30H31N3O5/c1-19-26-24(31-32-28(34)22-13-11-21(12-14-22)20-7-4-3-5-8-20)9-6-10-25(26)38-27(19)29(35)33-17-15-23(16-18-33)30(36)37-2/h3-5,7-8,11-14,23H,6,9-10,15-18H2,1-2H3,(H,32,34)/b31-24+