[(E)-(ethoxycarbonylhydrazinylidene)methyl] 2-(2-phenyl-2-piperazin-1-yl-piperidin-1-yl)ethanoate

Systemtic Name: [(E)-(ethoxycarbonylhydrazinylidene)methyl] 2-(2-phenyl-2-piperazin-1-yl-piperidin-1-yl)ethanoate Openeye Name: [(E)-(ethoxycarbonylhydrazono)methyl] 2-(2-phenyl-2-piperazin-1-yl-1-piperidyl)acetate CAS Name: 2-[2-phenyl-2-(1-piperazinyl)-1-piperidinyl]acetic acid [(E)-(ethoxycarbonylhydrazinylidene)methyl] ester IUPAC Name: [(E)-(ethoxycarbonylhydrazinylidene)methyl] 2-(2-phenyl-2-piperazin-1-ylpiperidin-1-yl)acetate Traditional Name: 2-(2-phenyl-2-piperazino-piperidino)acetic acid [(E)-(carbethoxyhydrazono)methyl] ester Formula: C21H31N5O4 MolecularWeight: 417.50194

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NN=COC(=O)CN1CCCCC1(C2=CC=CC=C2)N3CCNCC3

Isomeric SMILES

CCOC(=O)N/N=C/OC(=O)CN1CCCCC1(C2=CC=CC=C2)N3CCNCC3

InChI

InChI=1S/C21H31N5O4/c1-2-29-20(28)24-23-17-30-19(27)16-26-13-7-6-10-21(26,18-8-4-3-5-9-18)25-14-11-22-12-15-25/h3-5,8-9,17,22H,2,6-7,10-16H2,1H3,(H,24,28)/b23-17+