ethyl 7-[2,3-dimethoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenoxy]heptanoate

Systemtic Name: ethyl 7-[2,3-dimethoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenoxy]heptanoate Openeye Name: ethyl 7-[2,3-dimethoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenoxy]heptanoate CAS Name: 7-[2,3-dimethoxy-6-[(4-phenyl-1-piperazinyl)methyl]phenoxy]heptanoic acid ethyl ester IUPAC Name: ethyl 7-[2,3-dimethoxy-6-[(4-phenylpiperazin-1-yl)methyl]phenoxy]heptanoate Traditional Name: 7-[2,3-dimethoxy-6-[(4-phenylpiperazino)methyl]phenoxy]enanthic acid ethyl ester Formula: C28H40N2O5 MolecularWeight: 484.6276

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCCCCOC1=C(C=CC(=C1OC)OC)CN2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CCCCCCOC1=C(C=CC(=C1OC)OC)CN2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C28H40N2O5/c1-4-34-26(31)14-10-5-6-11-21-35-27-23(15-16-25(32-2)28(27)33-3)22-29-17-19-30(20-18-29)24-12-8-7-9-13-24/h7-9,12-13,15-16H,4-6,10-11,14,17-22H2,1-3H3