2-[3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-4H-isoquinoline-1,3-dione

Systemtic Name: 2-[3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxidanylidene-propyl]-4H-isoquinoline-1,3-dione Openeye Name: 2-[3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxo-propyl]-4H-isoquinoline-1,3-dione CAS Name: 2-[3-[4-[(4-methoxyphenyl)methyl]-1-piperazinyl]-3-oxopropyl]-4H-isoquinoline-1,3-dione IUPAC Name: 2-[3-[4-[(4-methoxyphenyl)methyl]piperazin-1-yl]-3-oxopropyl]-4H-isoquinoline-1,3-dione Traditional Name: 2-[3-keto-3-(4-p-anisylpiperazino)propyl]-4H-isoquinoline-1,3-quinone Formula: C24H27N3O4 MolecularWeight: 421.48888

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)CCN3C(=O)CC4=CC=CC=C4C3=O

Isomeric SMILES

COC1=CC=C(C=C1)CN2CCN(CC2)C(=O)CCN3C(=O)CC4=CC=CC=C4C3=O

InChI

InChI=1S/C24H27N3O4/c1-31-20-8-6-18(7-9-20)17-25-12-14-26(15-13-25)22(28)10-11-27-23(29)16-19-4-2-3-5-21(19)24(27)30/h2-9H,10-17H2,1H3