methyl 4-[[(2-azanyl-5-piperidin-1-ylcarbonyl-phenyl)amino]methyl]benzoate

Systemtic Name: methyl 4-[[(2-azanyl-5-piperidin-1-ylcarbonyl-phenyl)amino]methyl]benzoate Openeye Name: methyl 4-[[2-amino-5-(piperidine-1-carbonyl)anilino]methyl]benzoate CAS Name: 4-[[2-amino-5-[oxo(1-piperidinyl)methyl]anilino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-amino-5-(piperidine-1-carbonyl)anilino]methyl]benzoate Traditional Name: 4-[[2-amino-5-(piperidine-1-carbonyl)anilino]methyl]benzoic acid methyl ester Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)C(=O)N3CCCCC3)N

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC2=C(C=CC(=C2)C(=O)N3CCCCC3)N

InChI

InChI=1S/C21H25N3O3/c1-27-21(26)16-7-5-15(6-8-16)14-23-19-13-17(9-10-18(19)22)20(25)24-11-3-2-4-12-24/h5-10,13,23H,2-4,11-12,14,22H2,1H3