6,7-dimethoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4,4-dimethyl-isoquinoline-1,3-dione

Systemtic Name: 6,7-dimethoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4,4-dimethyl-isoquinoline-1,3-dione Openeye Name: 6,7-dimethoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4,4-dimethyl-isoquinoline-1,3-dione CAS Name: 6,7-dimethoxy-2-[3-[4-(2-methoxyphenyl)-1-piperazinyl]propyl]-4,4-dimethylisoquinoline-1,3-dione IUPAC Name: 6,7-dimethoxy-2-[3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]-4,4-dimethylisoquinoline-1,3-dione Traditional Name: 6,7-dimethoxy-2-[3-[4-(2-methoxyphenyl)piperazino]propyl]-4,4-dimethyl-isoquinoline-1,3-quinone Formula: C27H35N3O5 MolecularWeight: 481.5839

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC(=C(C=C2C(=O)N(C1=O)CCCN3CCN(CC3)C4=CC=CC=C4OC)OC)OC)C

Isomeric SMILES

CC1(C2=CC(=C(C=C2C(=O)N(C1=O)CCCN3CCN(CC3)C4=CC=CC=C4OC)OC)OC)C

InChI

InChI=1S/C27H35N3O5/c1-27(2)20-18-24(35-5)23(34-4)17-19(20)25(31)30(26(27)32)12-8-11-28-13-15-29(16-14-28)21-9-6-7-10-22(21)33-3/h6-7,9-10,17-18H,8,11-16H2,1-5H3