methyl 4-[[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]amino]benzoate

Systemtic Name: methyl 4-[[2-oxidanylidene-2-[(4-piperidin-1-ylphenyl)amino]ethyl]amino]benzoate Openeye Name: methyl 4-[[2-oxo-2-[4-(1-piperidyl)anilino]ethyl]amino]benzoate CAS Name: 4-[[2-oxo-2-[4-(1-piperidinyl)anilino]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-oxo-2-(4-piperidin-1-ylanilino)ethyl]amino]benzoate Traditional Name: 4-[[2-keto-2-(4-piperidinoanilino)ethyl]amino]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)NCC(=O)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)NCC(=O)NC2=CC=C(C=C2)N3CCCCC3

InChI

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