methyl 2-[phenyl-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]amino]ethanoate hydrochloride

Systemtic Name: methyl 2-[phenyl-[(4-pyridin-4-ylpiperazin-1-yl)carbonylamino]amino]ethanoate hydrochloride Openeye Name: methyl 2-(N-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]anilino)acetate hydrochloride CAS Name: 2-(N-[[oxo-(4-pyridin-4-yl-1-piperazinyl)methyl]amino]anilino)acetic acid methyl ester hydrochloride IUPAC Name: methyl 2-(N-[(4-pyridin-4-ylpiperazine-1-carbonyl)amino]anilino)acetate hydrochloride Traditional Name: 2-(N-[[4-(4-pyridyl)piperazine-1-carbonyl]amino]anilino)acetic acid methyl ester hydrochloride Formula: C19H24ClN5O3 MolecularWeight: 405.87856

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN(C1=CC=CC=C1)NC(=O)N2CCN(CC2)C3=CC=NC=C3.Cl

Isomeric SMILES

COC(=O)CN(C1=CC=CC=C1)NC(=O)N2CCN(CC2)C3=CC=NC=C3.Cl

InChI

InChI=1S/C19H23N5O3.ClH/c1-27-18(25)15-24(17-5-3-2-4-6-17)21-19(26)23-13-11-22(12-14-23)16-7-9-20-10-8-16;/h2-10H,11-15H2,1H3,(H,21,26);1H