[4-aminocarbonyl-4-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]cyclohex-2-en-1-yl] methanesulfonate

Systemtic Name: [4-aminocarbonyl-4-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]cyclohex-2-en-1-yl] methanesulfonate Openeye Name: [4-carbamoyl-4-[8-(4-methylpiperazin-1-yl)-2-naphthyl]cyclohex-2-en-1-yl] methanesulfonate CAS Name: methanesulfonic acid [4-carbamoyl-4-[8-(4-methyl-1-piperazinyl)-2-naphthalenyl]-1-cyclohex-2-enyl] ester IUPAC Name: [4-carbamoyl-4-[8-(4-methylpiperazin-1-yl)naphthalen-2-yl]cyclohex-2-en-1-yl] methanesulfonate Traditional Name: methanesulfonic acid [4-carbamoyl-4-[8-(4-methylpiperazino)-2-naphthyl]cyclohex-2-en-1-yl] ester Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=CC=CC3=C2C=C(C=C3)C4(CCC(C=C4)OS(=O)(=O)C)C(=O)N

Isomeric SMILES

CN1CCN(CC1)C2=CC=CC3=C2C=C(C=C3)C4(CCC(C=C4)OS(=O)(=O)C)C(=O)N

InChI

InChI=1S/C23H29N3O4S/c1-25-12-14-26(15-13-25)21-5-3-4-17-6-7-18(16-20(17)21)23(22(24)27)10-8-19(9-11-23)30-31(2,28)29/h3-8,10,16,19H,9,11-15H2,1-2H3,(H2,24,27)