methyl 2-azanyl-6-[2-(4-phenylpiperazin-1-yl)ethyl-pyridin-2-ylcarbonyl-amino]benzoate

Systemtic Name: methyl 2-azanyl-6-[2-(4-phenylpiperazin-1-yl)ethyl-pyridin-2-ylcarbonyl-amino]benzoate Openeye Name: methyl 2-amino-6-[2-(4-phenylpiperazin-1-yl)ethyl-(pyridine-2-carbonyl)amino]benzoate CAS Name: 2-amino-6-[[oxo(2-pyridinyl)methyl]-[2-(4-phenyl-1-piperazinyl)ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-amino-6-[2-(4-phenylpiperazin-1-yl)ethyl-(pyridine-2-carbonyl)amino]benzoate Traditional Name: 2-amino-6-[2-(4-phenylpiperazino)ethyl-picolinoyl-amino]benzoic acid methyl ester Formula: C26H29N5O3 MolecularWeight: 459.54016

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC=C1N(CCN2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=CC=N4)N

Isomeric SMILES

COC(=O)C1=C(C=CC=C1N(CCN2CCN(CC2)C3=CC=CC=C3)C(=O)C4=CC=CC=N4)N

InChI

InChI=1S/C26H29N5O3/c1-34-26(33)24-21(27)10-7-12-23(24)31(25(32)22-11-5-6-13-28-22)19-16-29-14-17-30(18-15-29)20-8-3-2-4-9-20/h2-13H,14-19,27H2,1H3