methyl 2-(4-chlorophenyl)-2-[4-(1-pyrazin-2-ylpiperidin-3-yl)carbonylpiperazin-1-yl]ethanoate

Systemtic Name: methyl 2-(4-chlorophenyl)-2-[4-(1-pyrazin-2-ylpiperidin-3-yl)carbonylpiperazin-1-yl]ethanoate Openeye Name: methyl 2-(4-chlorophenyl)-2-[4-(1-pyrazin-2-ylpiperidine-3-carbonyl)piperazin-1-yl]acetate CAS Name: 2-(4-chlorophenyl)-2-[4-[oxo-[1-(2-pyrazinyl)-3-piperidinyl]methyl]-1-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-(4-chlorophenyl)-2-[4-(1-pyrazin-2-ylpiperidine-3-carbonyl)piperazin-1-yl]acetate Traditional Name: 2-(4-chlorophenyl)-2-[4-(1-pyrazin-2-ylnipecotoyl)piperazino]acetic acid methyl ester Formula: C23H28ClN5O3 MolecularWeight: 457.95312

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCCN(C3)C4=NC=CN=C4

Isomeric SMILES

COC(=O)C(C1=CC=C(C=C1)Cl)N2CCN(CC2)C(=O)C3CCCN(C3)C4=NC=CN=C4

InChI

InChI=1S/C23H28ClN5O3/c1-32-23(31)21(17-4-6-19(24)7-5-17)27-11-13-28(14-12-27)22(30)18-3-2-10-29(16-18)20-15-25-8-9-26-20/h4-9,15,18,21H,2-3,10-14,16H2,1H3