[4-(6-methoxynaphthalen-2-yl)-3-[(4-methylpiperazin-1-yl)methyl]-4-oxidanyl-cyclohexyl] 2-methoxybenzoate

Systemtic Name: [4-(6-methoxynaphthalen-2-yl)-3-[(4-methylpiperazin-1-yl)methyl]-4-oxidanyl-cyclohexyl] 2-methoxybenzoate Openeye Name: [4-hydroxy-4-(6-methoxy-2-naphthyl)-3-[(4-methylpiperazin-1-yl)methyl]cyclohexyl] 2-methoxybenzoate CAS Name: 2-methoxybenzoic acid [4-hydroxy-4-(6-methoxy-2-naphthalenyl)-3-[(4-methyl-1-piperazinyl)methyl]cyclohexyl] ester IUPAC Name: [4-hydroxy-4-(6-methoxynaphthalen-2-yl)-3-[(4-methylpiperazin-1-yl)methyl]cyclohexyl] 2-methoxybenzoate Traditional Name: 2-methoxybenzoic acid [4-hydroxy-4-(6-methoxy-2-naphthyl)-3-[(4-methylpiperazino)methyl]cyclohexyl] ester Formula: C31H38N2O5 MolecularWeight: 518.64382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2CC(CCC2(C3=CC4=C(C=C3)C=C(C=C4)OC)O)OC(=O)C5=CC=CC=C5OC

Isomeric SMILES

CN1CCN(CC1)CC2CC(CCC2(C3=CC4=C(C=C3)C=C(C=C4)OC)O)OC(=O)C5=CC=CC=C5OC

InChI

InChI=1S/C31H38N2O5/c1-32-14-16-33(17-15-32)21-25-20-27(38-30(34)28-6-4-5-7-29(28)37-3)12-13-31(25,35)24-10-8-23-19-26(36-2)11-9-22(23)18-24/h4-11,18-19,25,27,35H,12-17,20-21H2,1-3H3