2-azanyl-1-[4-[10-(oxan-2-yloxy)decyl]piperazin-1-yl]-2-phenyl-ethanone

Systemtic Name: 2-azanyl-1-[4-[10-(oxan-2-yloxy)decyl]piperazin-1-yl]-2-phenyl-ethanone Openeye Name: 2-amino-2-phenyl-1-[4-(10-tetrahydropyran-2-yloxydecyl)piperazin-1-yl]ethanone CAS Name: 2-amino-1-[4-[10-(2-oxanyloxy)decyl]-1-piperazinyl]-2-phenylethanone IUPAC Name: 2-amino-1-[4-[10-(oxan-2-yloxy)decyl]piperazin-1-yl]-2-phenylethanone Traditional Name: 2-amino-2-phenyl-1-[4-(10-tetrahydropyran-2-yloxydecyl)piperazino]ethanone Formula: C27H45N3O3 MolecularWeight: 459.6645

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCCCCCCCCCN2CCN(CC2)C(=O)C(C3=CC=CC=C3)N

Isomeric SMILES

C1CCOC(C1)OCCCCCCCCCCN2CCN(CC2)C(=O)C(C3=CC=CC=C3)N

InChI

InChI=1S/C27H45N3O3/c28-26(24-14-8-7-9-15-24)27(31)30-20-18-29(19-21-30)17-11-5-3-1-2-4-6-12-22-32-25-16-10-13-23-33-25/h7-9,14-15,25-26H,1-6,10-13,16-23,28H2