methyl 2-[[(3S)-3-[(4-methoxyphenyl)amino]piperidin-1-yl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[(3S)-3-[(4-methoxyphenyl)amino]piperidin-1-yl]carbonylamino]benzoate Openeye Name: methyl 2-[[(3S)-3-(4-methoxyanilino)piperidine-1-carbonyl]amino]benzoate CAS Name: 2-[[[(3S)-3-(4-methoxyanilino)-1-piperidinyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[(3S)-3-(4-methoxyanilino)piperidine-1-carbonyl]amino]benzoate Traditional Name: 2-[[(3S)-3-(p-anisidino)piperidine-1-carbonyl]amino]benzoic acid methyl ester Formula: C21H25N3O4 MolecularWeight: 383.4409

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC2CCCN(C2)C(=O)NC3=CC=CC=C3C(=O)OC

Isomeric SMILES

COC1=CC=C(C=C1)N[C@H]2CCCN(C2)C(=O)NC3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C21H25N3O4/c1-27-17-11-9-15(10-12-17)22-16-6-5-13-24(14-16)21(26)23-19-8-4-3-7-18(19)20(25)28-2/h3-4,7-12,16,22H,5-6,13-14H2,1-2H3,(H,23,26)/t16-/m0/s1