1-[4-[8-(2,4-dimethoxyphenyl)quinolin-2-yl]piperazin-1-yl]-3-phenoxy-propan-2-ol

Systemtic Name: 1-[4-[8-(2,4-dimethoxyphenyl)quinolin-2-yl]piperazin-1-yl]-3-phenoxy-propan-2-ol Openeye Name: 1-[4-[8-(2,4-dimethoxyphenyl)-2-quinolyl]piperazin-1-yl]-3-phenoxy-propan-2-ol CAS Name: 1-[4-[8-(2,4-dimethoxyphenyl)-2-quinolinyl]-1-piperazinyl]-3-phenoxy-2-propanol IUPAC Name: 1-[4-[8-(2,4-dimethoxyphenyl)quinolin-2-yl]piperazin-1-yl]-3-phenoxypropan-2-ol Traditional Name: 1-[4-[8-(2,4-dimethoxyphenyl)-2-quinolyl]piperazino]-3-phenoxy-propan-2-ol Formula: C30H33N3O4 MolecularWeight: 499.60072

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)CC(COC5=CC=CC=C5)O)OC

Isomeric SMILES

COC1=CC(=C(C=C1)C2=CC=CC3=C2N=C(C=C3)N4CCN(CC4)CC(COC5=CC=CC=C5)O)OC

InChI

InChI=1S/C30H33N3O4/c1-35-25-12-13-26(28(19-25)36-2)27-10-6-7-22-11-14-29(31-30(22)27)33-17-15-32(16-18-33)20-23(34)21-37-24-8-4-3-5-9-24/h3-14,19,23,34H,15-18,20-21H2,1-2H3