methyl 3-(3-cyanophenyl)-5-(piperidin-4-ylmethyliminomethyl)benzoate

Systemtic Name: methyl 3-(3-cyanophenyl)-5-(piperidin-4-ylmethyliminomethyl)benzoate Openeye Name: methyl 3-(3-cyanophenyl)-5-(4-piperidylmethyliminomethyl)benzoate CAS Name: 3-(3-cyanophenyl)-5-(4-piperidinylmethyliminomethyl)benzoic acid methyl ester IUPAC Name: methyl 3-(3-cyanophenyl)-5-(piperidin-4-ylmethyliminomethyl)benzoate Traditional Name: 3-(3-cyanophenyl)-5-(4-piperidylmethyliminomethyl)benzoic acid methyl ester Formula: C22H23N3O2 MolecularWeight: 361.43692

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=CC(=C1)C=NCC2CCNCC2)C3=CC=CC(=C3)C#N

Isomeric SMILES

COC(=O)C1=CC(=CC(=C1)C=NCC2CCNCC2)C3=CC=CC(=C3)C#N

InChI

InChI=1S/C22H23N3O2/c1-27-22(26)21-11-18(15-25-14-16-5-7-24-8-6-16)10-20(12-21)19-4-2-3-17(9-19)13-23/h2-4,9-12,15-16,24H,5-8,14H2,1H3