1-[(4-methoxyphenyl)methyl]-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]quinolin-2-one

Systemtic Name: 1-[(4-methoxyphenyl)methyl]-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]quinolin-2-one Openeye Name: 1-[(4-methoxyphenyl)methyl]-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]quinolin-2-one CAS Name: 1-[(4-methoxyphenyl)methyl]-3-[[4-(2-pyrimidinyl)-1-piperazin-1-iumyl]methyl]-7,8-dihydro-6H-cyclopenta[g]quinolin-2-one IUPAC Name: 1-[(4-methoxyphenyl)methyl]-3-[(4-pyrimidin-2-ylpiperazin-1-ium-1-yl)methyl]-7,8-dihydro-6H-cyclopenta[g]quinolin-2-one Traditional Name: 1-p-anisyl-3-[[4-(2-pyrimidyl)piperazin-1-ium-1-yl]methyl]-7,8-dihydro-6H-cyclopenta[g]quinolin-2-one Formula: C29H32N5O2+ MolecularWeight: 482.59668

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CN2C3=CC4=C(CCC4)C=C3C=C(C2=O)C[NH+]5CCN(CC5)C6=NC=CC=N6

Isomeric SMILES

COC1=CC=C(C=C1)CN2C3=CC4=C(CCC4)C=C3C=C(C2=O)C[NH+]5CCN(CC5)C6=NC=CC=N6

InChI

InChI=1S/C29H31N5O2/c1-36-26-8-6-21(7-9-26)19-34-27-18-23-5-2-4-22(23)16-24(27)17-25(28(34)35)20-32-12-14-33(15-13-32)29-30-10-3-11-31-29/h3,6-11,16-18H,2,4-5,12-15,19-20H2,1H3/p+1