2-[2-[4-(4-ethylphenyl)piperazin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one

Systemtic Name: 2-[2-[4-(4-ethylphenyl)piperazin-1-yl]ethyl]-3-oxidanyl-3H-benzo[de]isoquinolin-1-one Openeye Name: 2-[2-[4-(4-ethylphenyl)piperazin-1-yl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one CAS Name: 2-[2-[4-(4-ethylphenyl)-1-piperazinyl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one IUPAC Name: 2-[2-[4-(4-ethylphenyl)piperazin-1-yl]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Traditional Name: 2-[2-[4-(4-ethylphenyl)piperazino]ethyl]-3-hydroxy-3H-benzo[de]isoquinolin-1-one Formula: C26H29N3O2 MolecularWeight: 415.52736

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N2CCN(CC2)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

Isomeric SMILES

CCC1=CC=C(C=C1)N2CCN(CC2)CCN3C(C4=CC=CC5=C4C(=CC=C5)C3=O)O

InChI

InChI=1S/C26H29N3O2/c1-2-19-9-11-21(12-10-19)28-16-13-27(14-17-28)15-18-29-25(30)22-7-3-5-20-6-4-8-23(24(20)22)26(29)31/h3-12,25,30H,2,13-18H2,1H3